Chembase list of 866358 unique molecular structures

1-[4-(4-fluorophenoxy)phenyl]ethan-1-one

$$$$ Data

M. F.

C14H11FO2

Suppliers	Catalog Number
Apollo Scientific	PC4228

Database	Data ID
PubChem	2759056

M. W.

230.2343432

CAS

35114-93-3

Similarity

N/A

ID: 97252

1-[6-(4-fluorophenyl)-2-methylpyridin-3-yl]ethan-1-one

$$$$ Data

M. F.

C14H12FNO

Suppliers	Catalog Number
Apollo Scientific	PC4229

Database	Data ID
PubChem	26985825

M. W.

229.2495832

CAS

Similarity

N/A

ID: 97253

1-ethenyl-2-fluorobenzene

$$$$ Data More

M. F.

C8H7F

Suppliers	Catalog Number
Sigma Aldrich	290505
Alfa Aesar	A17425
Apollo Scientific	PC4230

Database	Data ID
PubChem	123056

M. W.

122.1395832

CAS

394-46-7

Similarity

N/A

ID: 97254

3-(4-fluorophenyl)-1,2-oxazol-5-amine

$$$$ Data

M. F.

C9H7FN2O

Suppliers	Catalog Number
Apollo Scientific	PC4231
Enamine	EN300-10186

Database	Data ID
PubChem	2060332

M. W.

178.1630832

CAS

81465-82-9

Similarity

N/A

ID: 97255

3-chloro-2-fluorobenzene-1-sulfonyl chloride

$$$$ Data More

M. F.

C6H3Cl2FO2S

Suppliers	Catalog Number
Sigma Aldrich	558672
Alfa Aesar	L19511
Apollo Scientific	PC4233

Database	Data ID
PubChem	2778321

M. W.

229.0562232

CAS

351003-48-0

Similarity

N/A

ID: 97256

3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-5-amine

$$$$ Data

M. F.

C15H12FN3

Suppliers	Catalog Number
Apollo Scientific	PC4234
A&J Pharmtech	AJA-O32110

Database	Data ID
PubChem	3352034

M. W.

253.2742832

CAS

72411-53-1

Similarity

N/A

ID: 97257

3-(4-bromophenyl)-1-(4-fluorophenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C15H11BrFN3

Suppliers	Catalog Number
Apollo Scientific	PC4235

Database	Data ID
PubChem	1478040

M. W.

332.1703432

CAS

Similarity

N/A

ID: 97258

3-(4-fluorophenyl)-1-(4-methylphenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C16H14FN3

Suppliers	Catalog Number
Apollo Scientific	PC4236
Enamine	EN300-87055

Database	Data ID
PubChem	4171410

M. W.

267.3008632

CAS

618092-86-7

Similarity

N/A

ID: 97259

1-(4-chlorophenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C15H11ClFN3

Suppliers	Catalog Number
Apollo Scientific	PC4237

Database	Data ID
PubChem	5233527

M. W.

287.7193432

CAS

Similarity

N/A

ID: 97260

1-(4-bromophenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C15H11BrFN3

Suppliers	Catalog Number
Apollo Scientific	PC4238

Database	Data ID
PubChem	4661913

M. W.

332.1703432

CAS

Similarity

N/A

ID: 97261

1,3-bis(4-fluorophenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C15H11F2N3

Suppliers	Catalog Number
Apollo Scientific	PC4239

Database	Data ID
PubChem	3459102

M. W.

271.2647464

CAS

Similarity

N/A

ID: 97262

1-ethenyl-3-fluorobenzene

$$$$ Data More

M. F.

C8H7F

Suppliers	Catalog Number
Sigma Aldrich	219452
Alfa Aesar	A12406
Apollo Scientific	PC4240

Database	Data ID
PubChem	67691

M. W.

122.1395832

CAS

350-51-6

Similarity

N/A

ID: 97263

1,3-difluoro-2-methoxy-5-nitrobenzene

$$$$ Data

M. F.

C7H5F2NO3

Suppliers	Catalog Number
Apollo Scientific	PC4242
Chemik	CHB85976

Database	Data ID
PubChem	605060

M. W.

189.1163064

CAS

392-25-6

Similarity

N/A

ID: 97264

3,5-difluoro-4-methoxyaniline

$$$$ Data More

M. F.

C7H7F2NO

Suppliers	Catalog Number
Alfa Aesar	H26778
Apollo Scientific	PC4243
Chemik	CHB80771

Database	Data ID
PubChem	2783137

M. W.

159.1333864

CAS

363-47-3

Similarity

N/A

ID: 97265

1,3-difluoro-2-iodo-5-nitrobenzene

$$$$ Data

M. F.

C6H2F2INO2

Suppliers	Catalog Number
Apollo Scientific	PC4246

Database	Data ID
PubChem	2783141

M. W.

284.9868564

CAS

Similarity

N/A

ID: 97266

3-(4-fluorophenyl)-1-(4-methoxyphenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C16H14FN3O

Suppliers	Catalog Number
Apollo Scientific	PC4247

Database	Data ID
PubChem	4638289

M. W.

283.3002632

CAS

Similarity

N/A

ID: 97267

1-(3-chlorophenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C15H11ClFN3

Suppliers	Catalog Number
Apollo Scientific	PC4248

Database	Data ID
PubChem	4277230

M. W.

287.7193432

CAS

Similarity

N/A

ID: 97268

1-(4-fluorophenyl)-3-(2-methylphenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C16H14FN3

Suppliers	Catalog Number
Apollo Scientific	PC4249

Database	Data ID
PubChem	3535713

M. W.

267.3008632

CAS

Similarity

N/A

ID: 97269

1-(2-fluorophenyl)-3-(2-methylphenyl)-1H-pyrazol-5-amine

$$$$ Data

M. F.

C16H14FN3

Suppliers	Catalog Number
Apollo Scientific	PC4251

Database	Data ID
PubChem	4079128

M. W.

267.3008632

CAS

Similarity

N/A

ID: 97270

4-(5-fluoro-2-hydroxyphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-2-one

$$$$ Data

M. F.

C15H11FN2O2

Suppliers	Catalog Number
Sigma Aldrich	543845
Apollo Scientific	PC4252

Database	Data ID
PubChem	44554422

M. W.

270.2584432

CAS

351003-09-3

Similarity

N/A

ID: 97271

bromo[(2,4-difluorophenyl)methyl]zinc

$$$$ Data

M. F.

C7H5BrF2Zn

Suppliers	Catalog Number
Sigma Aldrich	520306
Apollo Scientific	PC4253

Database	Data ID
PubChem	2778322

M. W.

272.3954064

CAS

307496-26-0

Similarity

N/A

ID: 97272

2-(4-fluorobenzoyl)-6-nitro-1-benzofuran-3-amine

$$$$ Data

M. F.

C15H9FN2O4

Suppliers	Catalog Number
Apollo Scientific	PC4254

Database	Data ID
PubChem	26985832

M. W.

300.2413632

CAS

Similarity

N/A

ID: 97273

3-(3-chloro-6-fluoro-1-benzothiophen-2-yl)-3-oxopropanenitrile

$$$$ Data

M. F.

C11H5ClFNOS

Suppliers	Catalog Number
Apollo Scientific	PC4257

Database	Data ID
PubChem	26985834

M. W.

253.6799032

CAS

Similarity

N/A

ID: 97274

6-fluoro-3,4-dihydro-2H-1,4-benzoxazin-3-one

$$$$ Data More

M. F.

C8H6FNO2

Suppliers	Catalog Number
Sigma Aldrich	557412
Apollo Scientific	PC4258
Enamine	EN300-104465

Database	Data ID
PubChem	302897

M. W.

167.1371432

CAS

398-63-0

Similarity

N/A

ID: 97275

5-fluoro-2,3-dihydro-1,3-benzoxazol-2-one

$$$$ Data

M. F.

C7H4FNO2

Suppliers	Catalog Number
Sigma Aldrich	683264
Apollo Scientific	PC4259

Database	Data ID
PubChem	287208

M. W.

153.1105632

CAS

13451-79-1

Similarity

N/A

ID: 97276

4-chloro-6-fluoro-2-oxo-2H-chromene-3-carbaldehyde

$$$$ Data

M. F.

C10H4ClFO3

Suppliers	Catalog Number
Apollo Scientific	PC4260

Database	Data ID
PubChem	11708407

M. W.

226.5883632

CAS

Similarity

N/A

ID: 97277

6-fluoro-4-oxo-4H-chromene-3-carboxylic acid

$$$$ Data

M. F.

C10H5FO4

Suppliers	Catalog Number
Sigma Aldrich	543640
Apollo Scientific	PC4261

Database	Data ID
PubChem	4096045

M. W.

208.1427032

CAS

71346-17-3

Similarity

N/A

ID: 97278

2-(4-chlorophenyl)-3-(4-fluorophenyl)prop-2-enenitrile

$$$$ Data

M. F.

C15H9ClFN

Suppliers	Catalog Number
Apollo Scientific	PC4262

Database	Data ID
PubChem	71299618

M. W.

257.6900632

CAS

Similarity

N/A

ID: 97279

3-(4-chlorophenyl)-2-(4-fluorophenyl)prop-2-enenitrile

$$$$ Data

M. F.

C15H9ClFN

Suppliers	Catalog Number
Apollo Scientific	PC4263

Database	Data ID
PubChem	56846546

M. W.

257.6900632

CAS

Similarity

N/A

ID: 97280

2-(4-fluorophenyl)-3-phenylprop-2-enenitrile

$$$$ Data

M. F.

C15H10FN

Suppliers	Catalog Number
Apollo Scientific	PC4264

Database	Data ID
PubChem	71299619

M. W.

223.2450032

CAS

54648-47-4

Similarity

N/A

ID: 97281

fluoranesulfonic acid

$$$$ Data

M. F.

FHO3S

Suppliers	Catalog Number
Sigma Aldrich	236535 47500
Apollo Scientific	PC4265

Database	Data ID
Wikipedia	Fluorosulfuric_acid
PubChem	24603

M. W.

100.0695432

CAS

7789-21-1

Similarity

N/A

ID: 97282

[2-methoxy-4-(trifluoromethoxy)phenyl]boronic acid

$$$$ Data

M. F.

C8H8BF3O4

Suppliers	Catalog Number
Apollo Scientific	PC4266
Bide Pharmatech	BD76343
A&J Pharmtech	AJA-O33236

Database	Data ID
PubChem	22490042

M. W.

235.9529296

CAS

355836-10-1

Similarity

N/A

ID: 97283

2,4-difluoro-6-iodoaniline

$$$$ Data

M. F.

C6H4F2IN

Suppliers	Catalog Number
Apollo Scientific	PC4267

Database	Data ID
PubChem	26985827

M. W.

255.0039364

CAS

Similarity

N/A

ID: 97284

2-chloro-4-fluoro-1-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H3ClF4

Suppliers	Catalog Number
Apollo Scientific	PC4268
Bide Pharmatech	BD10182

Database	Data ID
PubChem	23235863

M. W.

198.5453328

CAS

94444-58-3

Similarity

N/A

ID: 97285

1-chloro-3-fluoro-2-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H3ClF4

Suppliers	Catalog Number
Apollo Scientific	PC4269

Database	Data ID
PubChem	16743980

M. W.

198.5453328

CAS

103889-37-8

Similarity

N/A

ID: 97286

3-chloro-4-fluorobenzoyl cyanide

$$$$ Data

M. F.

C8H3ClFNO

Suppliers	Catalog Number
Apollo Scientific	PC4270
A&J Pharmtech	AJA-O10260

Database	Data ID
PubChem	44717493

M. W.

183.5669232

CAS

80277-45-8

Similarity

N/A

ID: 97287

2-amino-2-[(3,4-dihydroxyphenyl)methyl]-3,3,3-trifluoropropanoic acid

$$$$ Data

M. F.

C10H10F3NO4

Suppliers	Catalog Number
Apollo Scientific	PC4271

Database	Data ID
PubChem	2777509

M. W.

265.1859096

CAS

Similarity

N/A

ID: 97288

3-chloro-2-fluorobenzoyl fluoride

$$$$ Data

M. F.

C7H3ClF2O

Suppliers	Catalog Number
Apollo Scientific	PC4272

Database	Data ID
PubChem	19850494

M. W.

176.5479264

CAS

85345-74-0

Similarity

N/A

ID: 97289

3-chloro-4-fluorobenzoyl fluoride

$$$$ Data

M. F.

C7H3ClF2O

Suppliers	Catalog Number
Apollo Scientific	PC4273

Database	Data ID
PubChem	19850498

M. W.

176.5479264

CAS

80277-51-6

Similarity

N/A

ID: 97290

2-amino-3-fluoro-3-methylbutanoic acid

$$$$ Data

M. F.

C5H10FNO2

Suppliers	Catalog Number
Sigma Aldrich	47581
Alfa Aesar	L15334
Apollo Scientific	PC4275

Database	Data ID
PubChem	338887

M. W.

135.1368032

CAS

43163-94-6

Similarity

N/A

ID: 97291

3-bromo-5-(trifluoromethyl)benzaldehyde

$$$$ Data More

M. F.

C8H4BrF3O

Suppliers	Catalog Number
Alfa Aesar	H26197
Apollo Scientific	PC4276
Chemik	CHB18513

Database	Data ID
PubChem	16115438

M. W.

253.0159696

CAS

477535-41-4

Similarity

N/A

ID: 97292

2-{[3-(trifluoromethyl)phenyl]sulfanyl}acetic acid

$$$$ Data

M. F.

C9H7F3O2S

Suppliers	Catalog Number
Alfa Aesar	H50283
Apollo Scientific	PC4277
Enamine	EN300-07707

Database	Data ID
PubChem	2801046

M. W.

236.2108896

CAS

102582-93-4

Similarity

N/A

ID: 97293

4-chloro-2-(trifluoromethyl)benzene-1-sulfonyl chloride

$$$$ Data

M. F.

C7H3Cl2F3O2S

Suppliers	Catalog Number
Apollo Scientific	PC4278
Enamine	EN300-07942

Database	Data ID
PubChem	3715205

M. W.

279.0637296

CAS

54090-42-5

Similarity

N/A

ID: 97294

tris(difluoromethyl)-1,3,5-triazine

$$$$ Data

M. F.

C6H3F6N3

Suppliers	Catalog Number
Apollo Scientific	PC4281

Database	Data ID
PubChem	15648511

M. W.

231.0985392

CAS

369-22-2

Similarity

N/A

ID: 97295

2-(tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)benzonitrile

$$$$ Data

M. F.

C14H15BF3NO2

Suppliers	Catalog Number
Apollo Scientific	PC4283
A&J Pharmtech	AJA-O20916

Database	Data ID
PubChem	45933641

M. W.

297.0806096

CAS

1073355-21-1

Similarity

N/A

ID: 97296

methyl 4-amino-2,3,5,6-tetrafluorobenzoate

$$$$ Data

M. F.

C8H5F4NO2

Suppliers	Catalog Number
Apollo Scientific	PC4284

Database	Data ID
PubChem	2782457

M. W.

223.1244128

CAS

715-37-7

Similarity

N/A

ID: 97297

bis(trifluoromethanesulfonyloxy)cerio trifluoromethanesulfonate

$$$$ Data

M. F.

C3CeF9O9S3

Suppliers	Catalog Number
Apollo Scientific	PC4288

Database	Data ID
PubChem	10952045

M. W.

587.3233288

CAS

76089-77-5

Similarity

N/A

ID: 97298

caesium(1+) ion tridecafluoroheptanoate

$$$$ Data

M. F.

C7CsF13O2

Suppliers	Catalog Number
Apollo Scientific	PC4289

Database	Data ID
PubChem	2783194

M. W.

495.9583916

CAS

171198-24-6

Similarity

N/A

ID: 97299

3-chloro-2,2,3-trifluoro-4,4-bis(trifluoromethyl)oxetane

$$$$ Data

M. F.

C5ClF9O

Suppliers	Catalog Number
Apollo Scientific	PC4290

Database	Data ID
PubChem	15184876

M. W.

282.4915288

CAS

Similarity

N/A

ID: 97300

4-fluorobenzene-1-thiol

$$$$ Data More

M. F.

C6H5FS

Suppliers	Catalog Number
Sigma Aldrich	F15315 47510
MP Biomedicals	05203700
Alfa Aesar	A17600

Database	Data ID
PubChem	67789

M. W.

128.1673032

CAS

371-42-6

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified