Chembase list of 866358 unique molecular structures

2-chloro-N-(3,4-dichlorophenyl)-4-nitrobenzamide

$$$$

M. F.

C13H7Cl3N2O3

Suppliers	Catalog Number
Alfa Aesar	H59469

Database

Data ID

M. W.

345.56528

CAS

Similarity

N/A

ID: 300702

N-(3,5-dimethylphenyl)-3-methylbenzamide

$$$$

M. F.

C16H17NO

Suppliers	Catalog Number
Alfa Aesar	H59470

Database

Data ID

M. W.

239.31228

CAS

346720-25-0

Similarity

N/A

ID: 300703

N-butyl-2,6-difluorobenzamide

$$$$

M. F.

C11H13F2NO

Suppliers	Catalog Number
Alfa Aesar	H59471

Database

Data ID

M. W.

213.2238264

CAS

Similarity

N/A

ID: 300704

4-(hydroxymethyl)-N,N-bis(2-methylpropyl)benzamide

$$$$

M. F.

C16H25NO2

Suppliers	Catalog Number
Alfa Aesar	H59472

Database

Data ID

M. W.

263.3752

CAS

549495-32-1

Similarity

N/A

ID: 300705

ethyl 4-chloro-7-(hydroxymethyl)quinoline-3-carboxylate

$$$$

M. F.

C13H12ClNO3

Suppliers	Catalog Number
Alfa Aesar	H59473

Database

Data ID

M. W.

265.69228

CAS

77156-85-5

Similarity

N/A

ID: 300706

ethyl 4,6-dichloro-8-methylquinoline-3-carboxylate

$$$$

M. F.

C13H11Cl2NO2

Suppliers	Catalog Number
Alfa Aesar	H59474

Database

Data ID

M. W.

284.13794

CAS

338954-50-0

Similarity

N/A

ID: 300707

4-chloro-N-(3,5-difluorophenyl)benzamide

$$$$

M. F.

C13H8ClF2NO

Suppliers	Catalog Number
Alfa Aesar	H59475

Database

Data ID

M. W.

267.6585264

CAS

838867-17-7

Similarity

N/A

ID: 300708

4-chloro-N-(3-chloro-4-methylphenyl)-3-nitrobenzamide

$$$$

M. F.

C14H10Cl2N2O3

Suppliers	Catalog Number
Alfa Aesar	H59477

Database

Data ID

M. W.

325.1468

CAS

Similarity

N/A

ID: 300709

N-(4-bromo-2-fluorophenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C14H11BrFNO2

Suppliers	Catalog Number
Alfa Aesar	H59478

Database

Data ID

M. W.

324.1450432

CAS

438481-18-6

Similarity

N/A

ID: 300710

2-(4-nitrophenyl)-5-(propan-2-yl)-2,5-diazabicyclo[2.2.1]heptane

$$$$

M. F.

C14H19N3O2

Suppliers	Catalog Number
Alfa Aesar	H59479

Database

Data ID

M. W.

261.31956

CAS

Similarity

N/A

ID: 300711

3-ethyl-1-methyl-1H-imidazol-3-ium methyl sulfate

$$$$

M. F.

C7H14N2O4S

Suppliers	Catalog Number
Alfa Aesar	H59480

Database

Data ID

M. W.

222.26206

CAS

516474-01-4

Similarity

N/A

ID: 300712

N-[(4-chlorophenyl)methyl]-2-methoxybenzamide

$$$$

M. F.

C15H14ClNO2

Suppliers	Catalog Number
Alfa Aesar	H59481

Database

Data ID

M. W.

275.73016

CAS

331989-09-4

Similarity

N/A

ID: 300713

N-(2-chloro-4-iodophenyl)-2-methoxybenzamide

$$$$

M. F.

C14H11ClINO2

Suppliers	Catalog Number
Alfa Aesar	H59482

Database

Data ID

M. W.

387.60011

CAS

424809-15-4

Similarity

N/A

ID: 300714

4-(hydroxymethyl)-N-[4-(trifluoromethyl)phenyl]benzamide

$$$$

M. F.

C15H12F3NO2

Suppliers	Catalog Number
Alfa Aesar	H59483

Database

Data ID

M. W.

295.2564896

CAS

150225-43-7

Similarity

N/A

ID: 300715

6-bromoquinoline-5-carbonitrile

$$$$

M. F.

C10H5BrN2

Suppliers	Catalog Number
Alfa Aesar	H59484

Database

Data ID

M. W.

233.0641

CAS

Similarity

N/A

ID: 300716

4-chloro-N,N-dimethylbenzamide

$$$$

M. F.

C9H10ClNO

Suppliers	Catalog Number
Alfa Aesar	H59486

Database

Data ID

M. W.

183.6348

CAS

14062-80-7

Similarity

N/A

ID: 300717

2-chloro-N-(2-ethylhexyl)benzamide

$$$$

M. F.

C15H22ClNO

Suppliers	Catalog Number
Alfa Aesar	H59488

Database

Data ID

M. W.

267.79428

CAS

Similarity

N/A

ID: 300718

N-(4-bromo-2-fluorophenyl)-2-fluorobenzamide

$$$$

M. F.

C13H8BrF2NO

Suppliers	Catalog Number
Alfa Aesar	H59489

Database

Data ID

M. W.

312.1095264

CAS

551906-53-7

Similarity

N/A

ID: 300719

N-(3,4-difluorophenyl)-3,5-dinitrobenzamide

$$$$

M. F.

C13H7F2N3O5

Suppliers	Catalog Number
Alfa Aesar	H59491

Database

Data ID

M. W.

323.2085864

CAS

Similarity

N/A

ID: 300720

2-chloro-N-(5-fluoro-2-methylphenyl)-4-nitrobenzamide

$$$$

M. F.

C14H10ClFN2O3

Suppliers	Catalog Number
Alfa Aesar	H59492

Database

Data ID

M. W.

308.6922032

CAS

Similarity

N/A

ID: 300721

3-ethyl-1-methyl-1H-imidazol-3-ium; cyanosulfanide

$$$$

M. F.

C7H11N3S

Suppliers	Catalog Number
Alfa Aesar	H59493

Database

Data ID

M. W.

169.24734

CAS

331717-63-6

Similarity

N/A

ID: 300722

2,6-difluoro-N,N-bis(2-methylpropyl)benzamide

$$$$

M. F.

C15H21F2NO

Suppliers	Catalog Number
Alfa Aesar	H59494

Database

Data ID

M. W.

269.3301464

CAS

Similarity

N/A

ID: 300723

N-(2-bromophenyl)-3,5-dinitrobenzamide

$$$$

M. F.

C13H8BrN3O5

Suppliers	Catalog Number
Alfa Aesar	H59497

Database

Data ID

M. W.

366.12372

CAS

Similarity

N/A

ID: 300724

2-chloro-N-(2,6-dichlorophenyl)benzamide

$$$$

M. F.

C13H8Cl3NO

Suppliers	Catalog Number
Alfa Aesar	H59498

Database

Data ID

M. W.

300.56772

CAS

200807-45-0

Similarity

N/A

ID: 300725

2-chloro-N-methyl-4-nitro-N-phenylbenzamide

$$$$

M. F.

C14H11ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59499

Database

Data ID

M. W.

290.70174

CAS

Similarity

N/A

ID: 300726

N-(4-bromo-2-fluorophenyl)benzamide

$$$$

M. F.

C13H9BrFNO

Suppliers	Catalog Number
Alfa Aesar	H59500

Database

Data ID

M. W.

294.1190632

CAS

551915-17-4

Similarity

N/A

ID: 300727

2-chloro-N,N-diethylbenzamide

$$$$

M. F.

C11H14ClNO

Suppliers	Catalog Number
Alfa Aesar	H59501

Database

Data ID

M. W.

211.68796

CAS

10345-79-6

Similarity

N/A

ID: 300728

2-fluoro-N-(3-fluoro-5-methylphenyl)benzamide

$$$$

M. F.

C14H11F2NO

Suppliers	Catalog Number
Alfa Aesar	H59502

Database

Data ID

M. W.

247.2400464

CAS

Similarity

N/A

ID: 300729

4-chloro-N-(2,4-difluorophenyl)-3-nitrobenzamide

$$$$

M. F.

C13H7ClF2N2O3

Suppliers	Catalog Number
Alfa Aesar	H59503

Database

Data ID

M. W.

312.6560864

CAS

Similarity

N/A

ID: 300730

4-chloro-N-(2,4-dimethylphenyl)butanamide

$$$$

M. F.

C12H16ClNO

Suppliers	Catalog Number
Alfa Aesar	H59505

Database

Data ID

M. W.

225.71454

CAS

Similarity

N/A

ID: 300731

4,5-dichloro-2-fluoroaniline

$$$$

M. F.

C6H4Cl2FN

Suppliers	Catalog Number
Alfa Aesar	H59506

Database

Data ID

M. W.

180.0070632

CAS

2729-36-4

Similarity

N/A

ID: 300732

N-(4-ethoxyphenyl)-3-nitrobenzamide

$$$$

M. F.

C15H14N2O4

Suppliers	Catalog Number
Alfa Aesar	H59507

Database

Data ID

M. W.

286.28266

CAS

Similarity

N/A

ID: 300733

2-fluoro-N-(2-fluoro-3-methylphenyl)benzamide

$$$$

M. F.

C14H11F2NO

Suppliers	Catalog Number
Alfa Aesar	H59508

Database

Data ID

M. W.

247.2400464

CAS

Similarity

N/A

ID: 300734

N-(3,5-dimethylphenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C16H17NO2

Suppliers	Catalog Number
Alfa Aesar	H59509

Database

Data ID

M. W.

255.31168

CAS

127291-98-9

Similarity

N/A

ID: 300735

4-chloro-N-(3-chloro-2-methylphenyl)-3-nitrobenzamide

$$$$

M. F.

C14H10Cl2N2O3

Suppliers	Catalog Number
Alfa Aesar	H59510

Database

Data ID

M. W.

325.1468

CAS

Similarity

N/A

ID: 300736

N-(3,5-difluorophenyl)-3-methylbenzamide

$$$$

M. F.

C14H11F2NO

Suppliers	Catalog Number
Alfa Aesar	H59511

Database

Data ID

M. W.

247.2400464

CAS

881765-81-7

Similarity

N/A

ID: 300737

N-(3,5-dichlorophenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C14H11Cl2NO2

Suppliers	Catalog Number
Alfa Aesar	H59512

Database

Data ID

M. W.

296.14864

CAS

316150-88-6

Similarity

N/A

ID: 300738

1-methyl-3-(prop-2-en-1-yl)-1H-imidazol-3-ium bromide

$$$$

M. F.

C7H11BrN2

Suppliers	Catalog Number
Alfa Aesar	H59513

Database

Data ID

M. W.

203.07964

CAS

31410-07-8

Similarity

N/A

ID: 300739

N-(2,4-difluorophenyl)-3,5-dinitrobenzamide

$$$$

M. F.

C13H7F2N3O5

Suppliers	Catalog Number
Alfa Aesar	H59514

Database

Data ID

M. W.

323.2085864

CAS

Similarity

N/A

ID: 300740

4-chloro-N-(2,5-dimethylphenyl)-3-nitrobenzamide

$$$$

M. F.

C15H13ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59516

Database

Data ID

M. W.

304.72832

CAS

Similarity

N/A

ID: 300741

N-(2,4-dibromophenyl)-2-methoxybenzamide

$$$$

M. F.

C14H11Br2NO2

Suppliers	Catalog Number
Alfa Aesar	H59517

Database

Data ID

M. W.

385.05064

CAS

540792-53-8

Similarity

N/A

ID: 300742

3,5-dinitro-N-phenylbenzamide

$$$$

M. F.

C13H9N3O5

Suppliers	Catalog Number
Alfa Aesar	H59518

Database

Data ID

M. W.

287.22766

CAS

Similarity

N/A

ID: 300743

tert-butyl N-[4-fluoro-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate

$$$$

M. F.

C17H25BFNO4

Suppliers	Catalog Number
Alfa Aesar	H59519

Database

Data ID

M. W.

337.1941032

CAS

Similarity

N/A

ID: 300744

N-(5-fluoro-2-methylphenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C15H14FNO2

Suppliers	Catalog Number
Alfa Aesar	H59521

Database

Data ID

M. W.

259.2755632

CAS

710310-26-2

Similarity

N/A

ID: 300745

N-(2,4-dimethoxyphenyl)-2-fluorobenzamide

$$$$

M. F.

C15H14FNO3

Suppliers	Catalog Number
Alfa Aesar	H59522

Database

Data ID

M. W.

275.2749632

CAS

349128-46-7

Similarity

N/A

ID: 300746

N-(2,4-dibromophenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C14H11Br2NO2

Suppliers	Catalog Number
Alfa Aesar	H59523

Database

Data ID

M. W.

385.05064

CAS

541545-55-5

Similarity

N/A

ID: 300747

N-(2-fluoro-5-methylphenyl)-3-methylbenzamide

$$$$

M. F.

C15H14FNO

Suppliers	Catalog Number
Alfa Aesar	H59524

Database

Data ID

M. W.

243.2761632

CAS

876933-54-9

Similarity

N/A

ID: 300748

N-(4-ethylphenyl)-2,6-difluorobenzamide

$$$$

M. F.

C15H13F2NO

Suppliers	Catalog Number
Alfa Aesar	H59525

Database

Data ID

M. W.

261.2666264

CAS

Similarity

N/A

ID: 300749

N-(2,5-difluorophenyl)-2-fluorobenzamide

$$$$

M. F.

C13H8F3NO

Suppliers	Catalog Number
Alfa Aesar	H59526

Database

Data ID

M. W.

251.2039296

CAS

903269-74-9

Similarity

N/A

ID: 300750

4-chloro-N-(3-iodophenyl)benzamide

$$$$

M. F.

C13H9ClINO

Suppliers	Catalog Number
Alfa Aesar	H59527

Database

Data ID

M. W.

357.57413

CAS

897761-86-3

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