Chembase list of 866358 unique molecular structures

bis(2-chloroethyl)(2-methoxyethyl)amine hydrochloride

$$$$ Data

M. F.

C7H16Cl3NO

Suppliers	Catalog Number
Apollo Scientific	OR16940

Database	Data ID
PubChem	119718

M. W.

236.56704

CAS

27807-62-1

Similarity

N/A

ID: 78002

naphthalene-2-carbonyl chloride

$$$$ Data More

M. F.

C11H7ClO

Suppliers	Catalog Number
Sigma Aldrich	250260 70680
MP Biomedicals	05216251
Alfa Aesar	A14046

Database	Data ID
PubChem	75246

M. W.

190.62568

CAS

2243-83-6

Similarity

N/A

ID: 78003

(2S)-but-3-yn-2-ol

$$$$ Data

M. F.

C4H6O

Suppliers	Catalog Number
Sigma Aldrich	464007
Alfa Aesar	L20345
Apollo Scientific	OR16943

Database	Data ID
PubChem	6995470

M. W.

70.08984

CAS

42969-65-3

Similarity

N/A

ID: 78004

2-amino-4,5-dichlorophenol

$$$$ Data

M. F.

C6H5Cl2NO

Suppliers	Catalog Number
Apollo Scientific	OR16946
Bide Pharmatech	BD231167

Database	Data ID
PubChem	3015415

M. W.

178.016

CAS

28443-57-4

Similarity

N/A

ID: 78005

5-hydroxy-2,8,9-trioxa-1-ferrabicyclo[3.3.2]decane-3,7,10-trione hydrate

$$$$ Data

M. F.

C6H7FeO8

Suppliers	Catalog Number
Apollo Scientific	OR16950

Database	Data ID
PubChem	51341966

M. W.

262.95998

CAS

3522-50-7

Similarity

N/A

ID: 78006

tetrabutylazanium acetate

$$$$ Data

M. F.

C18H39NO2

Suppliers	Catalog Number
Sigma Aldrich	401803 86849 335991 (more...)
Alfa Aesar	B24773 19279
Apollo Scientific	OR16951

Database	Data ID
PubChem	82707

M. W.

301.50776

CAS

10534-59-5

Similarity

N/A

ID: 78007

3-aminophenol

$$$$ Data More

M. F.

C6H7NO

Suppliers	Catalog Number
Sigma Aldrich	100242 36684 09130
MP Biomedicals	05204165
Alfa Aesar	A11943

Database	Data ID
Wikipedia	3-Aminophenol
PubChem	11568

M. W.

109.12588

CAS

591-27-5

Similarity

N/A

ID: 78008

2,5-diethyl 3,4-dihydroxythiophene-2,5-dicarboxylate

$$$$ Data

M. F.

C10H12O6S

Suppliers	Catalog Number
Sigma Aldrich	553174 547360
Apollo Scientific	OR16953
A&J Pharmtech	AJA-O34469

Database	Data ID
PubChem	245503

M. W.

260.26368

CAS

1822-66-8

Similarity

N/A

ID: 78009

6-{[4-(piperidin-1-yl)piperidin-1-yl]sulfonyl}-1H-1,2,3-benzotriazol-1-ol

$$$$ Data

M. F.

C16H23N5O3S

Suppliers	Catalog Number
Apollo Scientific	OR16954

Database	Data ID
PubChem	9907148

M. W.

365.45052

CAS

227471-63-8

Similarity

N/A

ID: 78010

sodium 2,6-dichlorobenzoate

$$$$ Data

M. F.

C7H3Cl2NaO2

Suppliers	Catalog Number
Apollo Scientific	OR16956

Database	Data ID
PubChem	23686931

M. W.

212.99329

CAS

10007-84-8

Similarity

N/A

ID: 78011

sodium 3,4-dichlorobenzoate

$$$$ Data

M. F.

C7H3Cl2NaO2

Suppliers	Catalog Number
Apollo Scientific	OR16957

Database	Data ID
PubChem	19205593

M. W.

212.99329

CAS

17274-10-1

Similarity

N/A

ID: 78012

sodium 3,5-dichlorobenzoate

$$$$ Data

M. F.

C7H3Cl2NaO2

Suppliers	Catalog Number
Apollo Scientific	OR16958

Database	Data ID
PubChem	51341968

M. W.

212.99329

CAS

Similarity

N/A

ID: 78013

nonane-1,9-diol

$$$$ Data More

M. F.

C9H20O2

Suppliers	Catalog Number
Sigma Aldrich	N29600 74270
Alfa Aesar	L06336
Apollo Scientific	OR16970

Database	Data ID
PubChem	19835

M. W.

160.2539

CAS

3937-56-2

Similarity

N/A

ID: 78014

4-(methylamino)benzonitrile

$$$$ Data More

M. F.

C8H8N2

Suppliers	Catalog Number
Sigma Aldrich	665843
Apollo Scientific	OR16971
Chemik	CHB27334

Database	Data ID
PubChem	10964551

M. W.

132.16252

CAS

4714-62-9

Similarity

N/A

ID: 78015

8-bromooctanoic acid

$$$$ Data More

M. F.

C8H15BrO2

Suppliers	Catalog Number
Sigma Aldrich	257583 17865
MP Biomedicals	05203753
Alfa Aesar	B25575

Database	Data ID
PubChem	548275

M. W.

223.1075

CAS

17696-11-6

Similarity

N/A

ID: 78016

(iodomethyl)cyclopentane

$$$$ Data

M. F.

C6H11I

Suppliers	Catalog Number
Sigma Aldrich	735329
Alfa Aesar	B25391
Apollo Scientific	OR16976

Database	Data ID
PubChem	2762531

M. W.

210.05601

CAS

27935-87-1

Similarity

N/A

ID: 78017

cyclopentanecarbaldehyde

$$$$ Data More

M. F.

C6H10O

Suppliers	Catalog Number
Sigma Aldrich	526037
Alfa Aesar	H56609
Apollo Scientific	OR16978

Database	Data ID
PubChem	70106

M. W.

98.143

CAS

872-53-7

Similarity

N/A

ID: 78018

3-amino-2-methylphenol

$$$$ Data

M. F.

C7H9NO

Suppliers	Catalog Number
Sigma Aldrich	225061
Apollo Scientific	OR16980
A&J Pharmtech	AJA-O5135

Database	Data ID
PubChem	104448

M. W.

123.15246

CAS

53222-92-7

Similarity

N/A

ID: 78019

(1H-indol-7-yl)boronic acid

$$$$ Data

M. F.

C8H8BNO2

Suppliers	Catalog Number
Apollo Scientific	OR16982

Database	Data ID
PubChem	2763287

M. W.

160.96562

CAS

210889-31-9

Similarity

N/A

ID: 78020

bis(4-nitrophenyl) carbonate

$$$$ Data More

M. F.

C13H8N2O7

Suppliers	Catalog Number
Sigma Aldrich	161691 15118
Alfa Aesar	L00290
Apollo Scientific	OR16983

Database	Data ID
PubChem	78756

M. W.

304.21182

CAS

5070-13-3

Similarity

N/A

ID: 78021

6-aminopyridin-3-ol hydrochloride

$$$$ Data

M. F.

C5H7ClN2O

Suppliers	Catalog Number
Apollo Scientific	OR16984

Database	Data ID
PubChem	45790888

M. W.

146.57488

CAS

856965-37-2

Similarity

N/A

ID: 78022

4-(cyanomethyl)benzoic acid

$$$$ Data

M. F.

C9H7NO2

Suppliers	Catalog Number
Apollo Scientific	OR16985
Enamine	EN300-119608

Database	Data ID
PubChem	270871

M. W.

161.15738

CAS

50685-26-2

Similarity

N/A

ID: 78023

2-(bromomethyl)benzoic acid

$$$$ Data

M. F.

C8H7BrO2

Suppliers	Catalog Number
Alfa Aesar	H28927
Apollo Scientific	OR16987
Bide Pharmatech	BD72223

Database	Data ID
PubChem	346003

M. W.

215.04398

CAS

7115-89-1

Similarity

N/A

ID: 78024

ethyl 1-hydroxycyclopropane-1-carboxylate

$$$$ Data

M. F.

C6H10O3

Suppliers	Catalog Number
Apollo Scientific	OR16989

Database	Data ID
PubChem	2733706

M. W.

130.1418

CAS

137682-89-4

Similarity

N/A

ID: 78025

2-[4-(2-methoxyethyl)phenoxymethyl]oxirane

$$$$ Data

M. F.

C12H16O3

Suppliers	Catalog Number
Apollo Scientific	OR16991
TRC	M262590

Database	Data ID
PubChem	92515

M. W.

208.25364

CAS

56718-70-8

Similarity

N/A

ID: 78026

3-phenylpyridine-2-carboxylic acid

$$$$ Data

M. F.

C12H9NO2

Suppliers	Catalog Number
Apollo Scientific	OR16992

Database	Data ID
PubChem	2762789

M. W.

199.20536

CAS

103863-15-6

Similarity

N/A

ID: 78027

4-phenyl-1,2,3,6-tetrahydropyridine hydrochloride

$$$$ Data

M. F.

C11H14ClN

Suppliers	Catalog Number
Sigma Aldrich	134740 416835
Apollo Scientific	OR16994
InterBioScreen	BB_SC-4193

Database	Data ID
PubChem	2723860

M. W.

195.68856

CAS

43064-12-6

Similarity

N/A

ID: 78028

1,3-dibromopropan-2-one

$$$$ Data More

M. F.

C3H4Br2O

Suppliers	Catalog Number
MP Biomedicals	05223803
Alfa Aesar	L00633
Apollo Scientific	OR16995

Database	Data ID
PubChem	69952

M. W.

215.87126

CAS

816-39-7

Similarity

N/A

ID: 78029

3-(3-chlorophenyl)-1H-pyrazole

$$$$ Data

M. F.

C9H7ClN2

Suppliers	Catalog Number
Apollo Scientific	OR17

Database	Data ID
PubChem	2735800

M. W.

178.61828

CAS

Similarity

N/A

ID: 78030

2-amino-4-methylpyridine-3-carbonitrile

$$$$ Data

M. F.

C7H7N3

Suppliers	Catalog Number
Apollo Scientific	OR17000
Enamine	EN300-102925

Database	Data ID
PubChem	10396887

M. W.

133.15058

CAS

71493-76-0

Similarity

N/A

ID: 78031

diiodomethane

$$$$ Data More

M. F.

CH2I2

Suppliers	Catalog Number
Sigma Aldrich	158429 07-3750
MP Biomedicals	05212020
Alfa Aesar	A15457

Database	Data ID
Wikipedia	Diiodomethane
PubChem	6346

M. W.

267.83552

CAS

75-11-6

Similarity

N/A

ID: 78032

(2-hydroxyethyl)urea

$$$$ Data

M. F.

C3H8N2O2

Suppliers	Catalog Number
Sigma Aldrich	554693
Apollo Scientific	OR17003

Database	Data ID
PubChem	73984

M. W.

104.10782

CAS

2078-71-9

Similarity

N/A

ID: 78033

N,N-diethyl-4-isocyanoaniline

$$$$ Data

M. F.

C11H14N2

Suppliers	Catalog Number
Apollo Scientific	OR17004

Database	Data ID
PubChem	11506542

M. W.

174.24226

CAS

42549-09-7

Similarity

N/A

ID: 78034

N-(4-bromo-2-phenylphenyl)acetamide

$$$$ Data

M. F.

C14H12BrNO

Suppliers	Catalog Number
Apollo Scientific	OR17005

Database	Data ID
PubChem	242400

M. W.

290.15518

CAS

7147-52-6

Similarity

N/A

ID: 78035

4-(benzyloxy)-5-methoxy-2-nitrobenzoic acid

$$$$ Data

M. F.

C15H13NO6

Suppliers	Catalog Number
Apollo Scientific	OR17006
A&J Pharmtech	AJA-O33602

Database	Data ID
PubChem	10859633

M. W.

303.26682

CAS

60547-92-4

Similarity

N/A

ID: 78036

1-cyano-N'-[(3,5-dichloro-2-hydroxyphenyl)amino]-N-[(3,5-dichloro-2-hydroxypheny...

$$$$ Data

M. F.

C14H7Cl4N5O2

Suppliers	Catalog Number
Apollo Scientific	OR17007

Database	Data ID
PubChem	14970469

M. W.

419.04968

CAS

114592-65-3

Similarity

N/A

ID: 78037

3-amino-2-cyanopropanoic acid

$$$$ Data

M. F.

C4H6N2O2

Suppliers	Catalog Number
Apollo Scientific	OR17008

Database	Data ID
PubChem	45933817

M. W.

114.10264

CAS

Similarity

N/A

ID: 78038

N-(2-hydroxyethyl)-2-methylprop-2-enamide

$$$$ Data

M. F.

C6H11NO2

Suppliers	Catalog Number
Apollo Scientific	OR17009

Database	Data ID
PubChem	10197699

M. W.

129.15704

CAS

5238-56-2

Similarity

N/A

ID: 78039

methyl(propan-2-yloxy)phosphinic acid

$$$$ Data

M. F.

C4H11O3P

Suppliers	Catalog Number
Apollo Scientific	OR17011

Database	Data ID
PubChem	15778

M. W.

138.102101

CAS

133415-68-6

Similarity

N/A

ID: 78040

trimethylsilyl

$$$$ Data

M. F.

C3H9Si

Suppliers	Catalog Number
Apollo Scientific	OR17012

Database	Data ID
PubChem	123362

M. W.

73.18906

CAS

993-07-7

Similarity

N/A

ID: 78041

6-methoxypyridine-3-sulfonyl chloride

$$$$ Data

M. F.

C6H6ClNO3S

Suppliers	Catalog Number
Apollo Scientific	OR17013
A&J Pharmtech	AJA-O30359

Database	Data ID
PubChem	22344709

M. W.

207.63474

CAS

312300-42-8

Similarity

N/A

ID: 78042

1-methoxycyclohexa-1,4-diene

$$$$ Data

M. F.

C7H10O

Suppliers	Catalog Number
Sigma Aldrich	216151
Apollo Scientific	OR17014

Database	Data ID
PubChem	76156

M. W.

110.1537

CAS

2886-59-1

Similarity

N/A

ID: 78043

(1R,2S)-1-N,2-N-dimethylcyclohexane-1,2-diamine

$$$$ Data

M. F.

C8H18N2

Suppliers	Catalog Number
Apollo Scientific	OR17015
TRC	B494800

Database	Data ID
PubChem	7020757

M. W.

142.24192

CAS

67579-81-1

Similarity

N/A

ID: 78044

5,6-dichloro-2,1,3-benzothiadiazole

$$$$ Data

M. F.

C6H2Cl2N2S

Suppliers	Catalog Number
Apollo Scientific	OR17016

Database	Data ID
PubChem	305495

M. W.

205.06448

CAS

17821-93-1

Similarity

N/A

ID: 78045

3-amino-4-nitrobenzoic acid

$$$$ Data

M. F.

C7H6N2O4

Suppliers	Catalog Number
Apollo Scientific	OR17019

Database	Data ID
PubChem	228071

M. W.

182.13354

CAS

6968-22-5

Similarity

N/A

ID: 78046

(2S)-2-{[(benzyloxy)carbonyl]amino}-3-phenylpropanoic acid

$$$$ Data More

M. F.

C17H17NO4

Suppliers	Catalog Number
Sigma Aldrich	C4377 359807 97000
MP Biomedicals	02101191
Alfa Aesar	L09102 A17182

Database	Data ID
PubChem	70878

M. W.

299.32118

CAS

1161-13-3

Similarity

N/A

ID: 78047

4-bromo-2,3-dihydro-1H-inden-2-one

$$$$ Data

M. F.

C9H7BrO

Suppliers	Catalog Number
Apollo Scientific	OR17022
A&J Pharmtech	AJA-O9859

Database	Data ID
PubChem	21073393

M. W.

211.05528

CAS

846032-36-8

Similarity

N/A

ID: 78048

2,4-dichlorophenol

$$$$ Data More

M. F.

C6H4Cl2O

Suppliers	Catalog Number
Sigma Aldrich	D6023 105953 35811 (more...)
MP Biomedicals	05210972
Alfa Aesar	A12065

Database	Data ID
Wikipedia	2,4-Dichlorophenol
PubChem	8449

M. W.

163.00136

CAS

120-83-2

Similarity

N/A

ID: 78049

bis((methylsulfanyl)methanimidamide); sulfuric acid

$$$$ Data More

M. F.

C4H14N4O4S3

Suppliers	Catalog Number
Sigma Aldrich	M84445 67730
MP Biomedicals	05203501
Alfa Aesar	A11044

Database	Data ID
PubChem	13347

M. W.

278.37336

CAS

867-44-7

Similarity

N/A

ID: 78050

(benzenesulfonyl)benzene

$$$$ Data More

M. F.

C12H10O2S

Suppliers	Catalog Number
Sigma Aldrich	P35359 45458 43330
MP Biomedicals	05204393
Alfa Aesar	L08232

Database	Data ID
Wikipedia	Diphenyl_sulfone
PubChem	31386

M. W.

218.2716

CAS

127-63-9

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