Chembase list of 866358 unique molecular structures

diethyl[4-(2-methoxyethoxy)but-2-yn-1-yl]amine

$$$$ Data

M. F.

C11H21NO2

Suppliers	Catalog Number
Apollo Scientific	OR26159

Database	Data ID
PubChem	2780146

M. W.

199.28994

CAS

Similarity

N/A

ID: 83352

2-[bis(prop-2-yn-1-yloxy)methyl]furan

$$$$ Data

M. F.

C11H10O3

Suppliers	Catalog Number
Apollo Scientific	OR26160

Database	Data ID
PubChem	2780148

M. W.

190.1953

CAS

Similarity

N/A

ID: 83353

2-[(2,3-dibromoprop-2-en-1-yl)oxy]ethan-1-ol

$$$$ Data

M. F.

C5H8Br2O2

Suppliers	Catalog Number
Apollo Scientific	OR26161

Database	Data ID
PubChem	5709172

M. W.

259.92382

CAS

Similarity

N/A

ID: 83354

2-phenyl-4-[(prop-2-yn-1-yloxy)methyl]-1,3-dioxolane

$$$$ Data

M. F.

C13H14O3

Suppliers	Catalog Number
Apollo Scientific	OR26162

Database	Data ID
PubChem	2780152

M. W.

218.24846

CAS

Similarity

N/A

ID: 83355

2,2-dimethyl-4-[(prop-2-en-1-yloxy)methyl]-1,3-dioxolane

$$$$ Data

M. F.

C9H16O3

Suppliers	Catalog Number
Apollo Scientific	OR26163

Database	Data ID
PubChem	2780154

M. W.

172.22154

CAS

Similarity

N/A

ID: 83356

2-methyl-2-phenyl-4-[(prop-2-yn-1-yloxy)methyl]-1,3-dioxolane

$$$$ Data

M. F.

C14H16O3

Suppliers	Catalog Number
Apollo Scientific	OR26164

Database	Data ID
PubChem	2780156

M. W.

232.27504

CAS

Similarity

N/A

ID: 83357

sodium 3-(2-chloroethoxy)propane-1-sulfonate

$$$$ Data

M. F.

C5H10ClNaO4S

Suppliers	Catalog Number
Apollo Scientific	OR26165

Database	Data ID
PubChem	2780158

M. W.

224.63827

CAS

Similarity

N/A

ID: 83358

1-[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]pyridin-1-ium chloride

$$$$ Data

M. F.

C11H14ClNO2

Suppliers	Catalog Number
Apollo Scientific	OR26166

Database	Data ID
PubChem	2780161

M. W.

227.68736

CAS

Similarity

N/A

ID: 83359

3-{[4-(2-cyanoethoxy)but-2-yn-1-yl]dimethylazaniumyl}propane-1-sulfonate

$$$$ Data

M. F.

C12H20N2O4S

Suppliers	Catalog Number
Apollo Scientific	OR26167

Database	Data ID
PubChem	1798174

M. W.

288.3632

CAS

Similarity

N/A

ID: 83360

3-{[4-(2-hydroxyethoxy)but-2-yn-1-yl]dimethylazaniumyl}propane-1-sulfonate

$$$$ Data

M. F.

C11H21NO5S

Suppliers	Catalog Number
Apollo Scientific	OR26168

Database	Data ID
PubChem	2780166

M. W.

279.35314

CAS

Similarity

N/A

ID: 83361

ethyl 2-{[(2-chloroethyl)carbamoyl]amino}-3-phenylpropanoate

$$$$ Data

M. F.

C14H19ClN2O3

Suppliers	Catalog Number
Apollo Scientific	OR26169

Database	Data ID
PubChem	2780169

M. W.

298.76526

CAS

Similarity

N/A

ID: 83362

1,5-bis(3-bromopropanoyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one

$$$$ Data

M. F.

C15H16Br2N2O3

Suppliers	Catalog Number
Apollo Scientific	OR26170

Database	Data ID
PubChem	2780171

M. W.

432.10714

CAS

Similarity

N/A

ID: 83363

2-{4-[bis(2-chloroethyl)amino]phenyl}acetic acid

$$$$ Data

M. F.

C12H15Cl2NO2

Suppliers	Catalog Number
Apollo Scientific	OR26171

Database	Data ID
PubChem	25306

M. W.

276.159

CAS

Similarity

N/A

ID: 83364

5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxine

$$$$ Data

M. F.

C9H7N3O9

Suppliers	Catalog Number
Apollo Scientific	OR26172

Database	Data ID
PubChem	2780172

M. W.

301.16658

CAS

Similarity

N/A

ID: 83365

6,8-dibromo-2,3-dihydro-1,4-benzodioxin-5-ol

$$$$ Data

M. F.

C8H6Br2O3

Suppliers	Catalog Number
Apollo Scientific	OR26173

Database	Data ID
PubChem	2780173

M. W.

309.93944

CAS

Similarity

N/A

ID: 83366

[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]trimethylazanium chloride

$$$$ Data

M. F.

C13H18ClNO3

Suppliers	Catalog Number
Apollo Scientific	OR26174

Database	Data ID
PubChem	2780175

M. W.

271.73992

CAS

Similarity

N/A

ID: 83367

2-chloro-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one

$$$$ Data

M. F.

C10H9ClO3

Suppliers	Catalog Number
Sigma Aldrich	532584
Apollo Scientific	OR26175
InterBioScreen	BB_SC-5892

Database	Data ID
PubChem	2780178

M. W.

212.62966

CAS

93439-37-3

Similarity

N/A

ID: 83368

1-(5-hydroxy-2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one

$$$$ Data

M. F.

C10H10O4

Suppliers	Catalog Number
Apollo Scientific	OR26176

Database	Data ID
PubChem	2780179

M. W.

194.184

CAS

Similarity

N/A

ID: 83369

6-ethyl-2,3-dihydro-1,4-benzodioxin-5-ol

$$$$ Data

M. F.

C10H12O3

Suppliers	Catalog Number
Apollo Scientific	OR26177

Database	Data ID
PubChem	2780181

M. W.

180.20048

CAS

Similarity

N/A

ID: 83370

methyl 3-chloro-2,6-dihydroxybenzoate

$$$$ Data

M. F.

C8H7ClO4

Suppliers	Catalog Number
Apollo Scientific	OR26179

Database	Data ID
PubChem	2780184

M. W.

202.59178

CAS

Similarity

N/A

ID: 83371

4-(prop-2-en-1-yl)-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

$$$$ Data

M. F.

C10H10N4S

Suppliers	Catalog Number
Apollo Scientific	OR26180
Enamine	EN300-110596

Database	Data ID
PubChem	2780186

M. W.

218.2782

CAS

91813-63-7

Similarity

N/A

ID: 83372

3-(dimethylsulfamoyl)-4-methoxy-N-(2,2,2-trichloro-1-hydroxyethyl)benzamide

$$$$ Data

M. F.

C12H15Cl3N2O5S

Suppliers	Catalog Number
Apollo Scientific	OR26181

Database	Data ID
PubChem	2780188

M. W.

405.6819

CAS

Similarity

N/A

ID: 83373

N-(5-oxo-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

$$$$ Data

M. F.

C12H13NO2

Suppliers	Catalog Number
Maybridge	NRB00998
Apollo Scientific	OR26182

Database	Data ID
PubChem	2780190

M. W.

203.23712

CAS

88611-67-0

Similarity

N/A

ID: 83374

6-amino-1,2,3,4-tetrahydronaphthalen-1-one

$$$$ Data More

M. F.

C10H11NO

Suppliers	Catalog Number
Sigma Aldrich	678422
Alfa Aesar	H32028
Maybridge	NRB00999

Database	Data ID
PubChem	339537

M. W.

161.20044

CAS

3470-53-9

Similarity

N/A

ID: 83375

5-amino-2,3-dihydro-1H-inden-1-one

$$$$ Data

M. F.

C9H9NO

Suppliers	Catalog Number
Maybridge	NRB01003
Apollo Scientific	OR26184
Bide Pharmatech	BD7771

Database	Data ID
PubChem	312890

M. W.

147.17386

CAS

3470-54-0

Similarity

N/A

ID: 83376

1-[(2,4-dinitrophenyl)methyl]-2,4-dinitrobenzene

$$$$ Data

M. F.

C13H8N4O8

Suppliers	Catalog Number
Apollo Scientific	OR26185
TRC	T305825

Database	Data ID
PubChem	233592

M. W.

348.22462

CAS

1817-76-1

Similarity

N/A

ID: 83377

1-(bromomethyl)-2-[2-(bromomethyl)phenyl]benzene

$$$$ Data

M. F.

C14H12Br2

Suppliers	Catalog Number
Sigma Aldrich	330647
Apollo Scientific	OR26186

Database	Data ID
PubChem	251962

M. W.

340.05308

CAS

38274-14-5

Similarity

N/A

ID: 83378

N-(2-bromoethyl)-4-[2-(2-chloro-4-nitrophenyl)diazen-1-yl]-2-methylaniline

$$$$ Data

M. F.

C15H14BrClN4O2

Suppliers	Catalog Number
Apollo Scientific	OR26187

Database	Data ID
PubChem	2780197

M. W.

397.65426

CAS

Similarity

N/A

ID: 83379

4-bromo-N,N,2,6-tetramethylaniline

$$$$ Data

M. F.

C10H14BrN

Suppliers	Catalog Number
Alfa Aesar	H50584
Apollo Scientific	OR26188

Database	Data ID
PubChem	142731

M. W.

228.12886

CAS

50638-54-5

Similarity

N/A

ID: 83380

1-nitro-4-phenylbenzene

$$$$ Data

M. F.

C12H9NO2

Suppliers	Catalog Number
Apollo Scientific	OR26189
TRC	N493710
Bide Pharmatech	BD99465

Database	Data ID
PubChem	7114

M. W.

199.20536

CAS

92-93-3

Similarity

N/A

ID: 83381

(4-methylpyridin-2-yl)boronic acid

$$$$ Data

M. F.

C6H8BNO2

Suppliers	Catalog Number
Apollo Scientific	OR2619
A&J Pharmtech	AJA-O34446

Database	Data ID
PubChem	2762744

M. W.

136.94422

CAS

372963-48-9

Similarity

N/A

ID: 83382

2-methoxy-1-nitronaphthalene

$$$$ Data

M. F.

C11H9NO3

Suppliers	Catalog Number
Apollo Scientific	OR26190

Database	Data ID
PubChem	78614

M. W.

203.19406

CAS

Similarity

N/A

ID: 83383

sodium 4-chloro-3-nitrobenzene-1-sulfonate

$$$$ Data

M. F.

C6H3ClNNaO5S

Suppliers	Catalog Number
Sigma Aldrich	227250
Apollo Scientific	OR26191

Database	Data ID
PubChem	87246

M. W.

259.59949

CAS

17691-19-9

Similarity

N/A

ID: 83384

4-[(4-chloro-3-nitrophenyl)[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline

$$$$ Data

M. F.

C23H24ClN3O2

Suppliers	Catalog Number
Apollo Scientific	OR26193

Database	Data ID
PubChem	2780202

M. W.

409.90856

CAS

Similarity

N/A

ID: 83385

methyl 5-(azidomethyl)-1-phenyl-1H-1,2,3-triazole-4-carboxylate

$$$$ Data

M. F.

C11H10N6O2

Suppliers	Catalog Number
Apollo Scientific	OR26194

Database	Data ID
PubChem	555218

M. W.

258.2361

CAS

Similarity

N/A

ID: 83386

3,3-dimethyl-2-oxo-N,N,N-triphenylbutanecarbohydrazonoyl cyanide

$$$$ Data

M. F.

C25H24N3OP

Suppliers	Catalog Number
Apollo Scientific	OR26195

Database	Data ID
PubChem	9582279

M. W.

413.451321

CAS

Similarity

N/A

ID: 83387

2-bromo-N-(diphenoxyphosphoryl)propanamide

$$$$ Data

M. F.

C15H15BrNO4P

Suppliers	Catalog Number
Apollo Scientific	OR26196

Database	Data ID
PubChem	2780207

M. W.

384.161661

CAS

Similarity

N/A

ID: 83388

5-methyl-4-phenyl-1,2,3-thiadiazole

$$$$ Data

M. F.

C9H8N2S

Suppliers	Catalog Number
Alfa Aesar	H51827
Maybridge	NRB01209
Apollo Scientific	OR26197

Database	Data ID
PubChem	338037

M. W.

176.23822

CAS

64273-28-5

Similarity

N/A

ID: 83389

2,2,2-trichloro-1-(dimethoxyphosphoryl)ethyl N-butylcarbamate

$$$$ Data

M. F.

C9H17Cl3NO5P

Suppliers	Catalog Number
Apollo Scientific	OR26198

Database	Data ID
PubChem	2780210

M. W.

356.567741

CAS

Similarity

N/A

ID: 83390

2,2,2-trichloro-1-(dimethoxyphosphoryl)ethyl N-(3-chlorophenyl)carbamate

$$$$ Data

M. F.

C11H12Cl4NO5P

Suppliers	Catalog Number
Apollo Scientific	OR26199

Database	Data ID
PubChem	2780212

M. W.

411.002441

CAS

Similarity

N/A

ID: 83391

2,2,2-trichloro-1-(dimethoxyphosphoryl)ethyl N-(4-chlorophenyl)carbamate

$$$$ Data

M. F.

C11H12Cl4NO5P

Suppliers	Catalog Number
Apollo Scientific	OR26200

Database	Data ID
PubChem	2780214

M. W.

411.002441

CAS

Similarity

N/A

ID: 83392

2,2,2-trichloro-1-(dimethoxyphosphoryl)ethyl N-(3-chloro-4-methylphenyl)carbamat...

$$$$ Data

M. F.

C12H14Cl4NO5P

Suppliers	Catalog Number
Apollo Scientific	OR26201

Database	Data ID
PubChem	2780216

M. W.

425.029021

CAS

Similarity

N/A

ID: 83393

2-hydroxy-5,5-dimethyl-2,5-dihydro-1,2$l^{5}-oxaphosphol-2-one

$$$$ Data

M. F.

C5H9O3P

Suppliers	Catalog Number
Apollo Scientific	OR26202

Database	Data ID
PubChem	2780218

M. W.

148.096921

CAS

Similarity

N/A

ID: 83394

N,5-dinitropyridin-2-amine

$$$$ Data

M. F.

C5H4N4O4

Suppliers	Catalog Number
Apollo Scientific	OR26203

Database	Data ID
PubChem	2780220

M. W.

184.10966

CAS

Similarity

N/A

ID: 83395

5-chloro-3-[1-(dimethylamino)-3-oxoprop-1-en-2-yl]-1-phenyl-1H-pyrazole-4-carbal...

$$$$ Data

M. F.

C15H14ClN3O2

Suppliers	Catalog Number
Apollo Scientific	OR26204

Database	Data ID
PubChem	2780222

M. W.

303.74356

CAS

Similarity

N/A

ID: 83396

ethyl 5-(4-tert-butylphenyl)-5-chloro-2-cyanopenta-2,4-dienoate

$$$$ Data

M. F.

C18H20ClNO2

Suppliers	Catalog Number
Apollo Scientific	OR26206

Database	Data ID
PubChem	5709180

M. W.

317.8099

CAS

Similarity

N/A

ID: 83397

6-chloro-1-phenyl-5-[(2-phenylhydrazin-1-ylidene)methyl]-1,2,3,4-tetrahydropyrid...

$$$$ Data

M. F.

C18H16ClN3O

Suppliers	Catalog Number
Apollo Scientific	OR26207

Database	Data ID
PubChem	9582281

M. W.

325.79214

CAS

Similarity

N/A

ID: 83398

1-(2,2-dichlorocyclopropyl)-4-methoxybenzene

$$$$ Data

M. F.

C10H10Cl2O

Suppliers	Catalog Number
Apollo Scientific	OR26208

Database	Data ID
PubChem	2780231

M. W.

217.0918

CAS

Similarity

N/A

ID: 83399

1,1-dibromo-2-pentylcyclopropane

$$$$ Data

M. F.

C8H14Br2

Suppliers	Catalog Number
Apollo Scientific	OR26209

Database	Data ID
PubChem	572934

M. W.

270.00476

CAS

Similarity

N/A

ID: 83400

1,1-dibromo-3-chloro-2,2-dimethylcyclopropane

$$$$ Data

M. F.

C5H7Br2Cl

Suppliers	Catalog Number
Apollo Scientific	OR26210

Database	Data ID
PubChem	2780235

M. W.

262.37008

CAS

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