Chembase list of 866358 unique molecular structures

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

$$$$

M. F.

C14H11Cl2NO

Suppliers	Catalog Number
Alfa Aesar	H59829

Database

Data ID

M. W.

280.14924

CAS

7017-26-7

Similarity

N/A

ID: 301002

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

$$$$

M. F.

C13H8Cl2N2O3

Suppliers	Catalog Number
Alfa Aesar	H59830

Database

Data ID

M. W.

311.12022

CAS

Similarity

N/A

ID: 301003

2,6-difluoro-N-(3-fluorophenyl)benzamide

$$$$

M. F.

C13H8F3NO

Suppliers	Catalog Number
Alfa Aesar	H59831

Database

Data ID

M. W.

251.2039296

CAS

Similarity

N/A

ID: 301004

N-(3-chloro-2-methylphenyl)-2,6-difluorobenzamide

$$$$

M. F.

C14H10ClF2NO

Suppliers	Catalog Number
Alfa Aesar	H59832

Database

Data ID

M. W.

281.6851064

CAS

Similarity

N/A

ID: 301005

2-methoxy-N-propylbenzamide

$$$$

M. F.

C11H15NO2

Suppliers	Catalog Number
Alfa Aesar	H59834

Database

Data ID

M. W.

193.2423

CAS

550300-22-6

Similarity

N/A

ID: 301006

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

$$$$

M. F.

C13H8Cl2INO

Suppliers	Catalog Number
Alfa Aesar	H59835

Database

Data ID

M. W.

392.01919

CAS

897848-50-9

Similarity

N/A

ID: 301007

4-chloro-N-cyclohexyl-2-nitrobenzamide

$$$$

M. F.

C13H15ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59836

Database

Data ID

M. W.

282.7228

CAS

Similarity

N/A

ID: 301008

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

$$$$

M. F.

C14H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59837

Database

Data ID

M. W.

263.6946432

CAS

304645-25-8

Similarity

N/A

ID: 301009

4-chloro-N-(3,4-dimethoxyphenyl)-3-nitrobenzamide

$$$$

M. F.

C15H13ClN2O5

Suppliers	Catalog Number
Alfa Aesar	H59841

Database

Data ID

M. W.

336.72712

CAS

Similarity

N/A

ID: 301010

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

$$$$

M. F.

C15H13N3O5

Suppliers	Catalog Number
Alfa Aesar	H59844

Database

Data ID

M. W.

315.28082

CAS

36293-10-4

Similarity

N/A

ID: 301011

N-benzyl-4-chloro-N-phenylbenzamide

$$$$

M. F.

C20H16ClNO

Suppliers	Catalog Number
Alfa Aesar	H59845

Database

Data ID

M. W.

321.80014

CAS

701918-26-5

Similarity

N/A

ID: 301012

N-(4-bromo-2-methylphenyl)-4-chlorobenzamide

$$$$

M. F.

C14H11BrClNO

Suppliers	Catalog Number
Alfa Aesar	H59846

Database

Data ID

M. W.

324.60024

CAS

313548-74-2

Similarity

N/A

ID: 301013

N-(4-bromo-2-chlorophenyl)-4-chlorobenzamide

$$$$

M. F.

C13H8BrCl2NO

Suppliers	Catalog Number
Alfa Aesar	H59847

Database

Data ID

M. W.

345.01872

CAS

898648-07-2

Similarity

N/A

ID: 301014

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

$$$$

M. F.

C15H13ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59848

Database

Data ID

M. W.

304.72832

CAS

Similarity

N/A

ID: 301015

N-(4-chloro-2-methylphenyl)-2-fluorobenzamide

$$$$

M. F.

C14H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59849

Database

Data ID

M. W.

263.6946432

CAS

459130-69-9

Similarity

N/A

ID: 301016

N,N-bis(2-methylpropyl)-3,5-dinitrobenzamide

$$$$

M. F.

C15H21N3O5

Suppliers	Catalog Number
Alfa Aesar	H59850

Database

Data ID

M. W.

323.34434

CAS

Similarity

N/A

ID: 301017

N-benzyl-4-chloro-N-phenylbutanamide

$$$$

M. F.

C17H18ClNO

Suppliers	Catalog Number
Alfa Aesar	H59851

Database

Data ID

M. W.

287.78392

CAS

Similarity

N/A

ID: 301018

N-(4-ethylphenyl)-3-methylbenzamide

$$$$

M. F.

C16H17NO

Suppliers	Catalog Number
Alfa Aesar	H59852

Database

Data ID

M. W.

239.31228

CAS

346663-85-2

Similarity

N/A

ID: 301019

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

$$$$

M. F.

C10H10Cl3NO

Suppliers	Catalog Number
Alfa Aesar	H59853

Database

Data ID

M. W.

266.5515

CAS

Similarity

N/A

ID: 301020

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

$$$$

M. F.

C14H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59854

Database

Data ID

M. W.

263.6946432

CAS

331445-10-4

Similarity

N/A

ID: 301021

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

$$$$

M. F.

C13H8Cl2FNO

Suppliers	Catalog Number
Alfa Aesar	H59855

Database

Data ID

M. W.

284.1131232

CAS

546067-70-3

Similarity

N/A

ID: 301022

4-chloro-N-(2,4-dichlorophenyl)benzamide

$$$$

M. F.

C13H8Cl3NO

Suppliers	Catalog Number
Alfa Aesar	H59856

Database

Data ID

M. W.

300.56772

CAS

328262-15-3

Similarity

N/A

ID: 301023

2-chloro-N-[(4-fluorophenyl)methyl]-4-nitrobenzamide

$$$$

M. F.

C14H10ClFN2O3

Suppliers	Catalog Number
Alfa Aesar	H59857

Database

Data ID

M. W.

308.6922032

CAS

Similarity

N/A

ID: 301024

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

$$$$

M. F.

C13H7Cl3N2O3

Suppliers	Catalog Number
Alfa Aesar	H59858

Database

Data ID

M. W.

345.56528

CAS

Similarity

N/A

ID: 301025

4-chloro-N-(3,4-dimethoxyphenyl)butanamide

$$$$

M. F.

C12H16ClNO3

Suppliers	Catalog Number
Alfa Aesar	H59859

Database

Data ID

M. W.

257.71334

CAS

Similarity

N/A

ID: 301026

N,N-dicyclohexyl-2-methoxybenzamide

$$$$

M. F.

C20H29NO2

Suppliers	Catalog Number
Alfa Aesar	H59860

Database

Data ID

M. W.

315.44976

CAS

353785-72-5

Similarity

N/A

ID: 301027

1-benzyl-3-(3-fluoro-4-methylphenyl)urea

$$$$

M. F.

C15H15FN2O

Suppliers	Catalog Number
Alfa Aesar	H59861

Database

Data ID

M. W.

258.2908032

CAS

Similarity

N/A

ID: 301028

N-(3-fluorophenyl)-3,5-dinitrobenzamide

$$$$

M. F.

C13H8FN3O5

Suppliers	Catalog Number
Alfa Aesar	H59862

Database

Data ID

M. W.

305.2181232

CAS

Similarity

N/A

ID: 301029

N-(4-bromo-3-methylphenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C15H14BrNO2

Suppliers	Catalog Number
Alfa Aesar	H59863

Database

Data ID

M. W.

320.18116

CAS

111142-32-6

Similarity

N/A

ID: 301030

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

$$$$

M. F.

C13H7Cl2N3O5

Suppliers	Catalog Number
Alfa Aesar	H59864

Database

Data ID

M. W.

356.11778

CAS

Similarity

N/A

ID: 301031

N-(2-fluoro-4-methylphenyl)-2-methoxybenzamide

$$$$

M. F.

C15H14FNO2

Suppliers	Catalog Number
Alfa Aesar	H59865

Database

Data ID

M. W.

259.2755632

CAS

1037953-64-2

Similarity

N/A

ID: 301032

4-chloro-N-(2,5-dichlorophenyl)benzamide

$$$$

M. F.

C13H8Cl3NO

Suppliers	Catalog Number
Alfa Aesar	H59867

Database

Data ID

M. W.

300.56772

CAS

2447-97-4

Similarity

N/A

ID: 301033

N-(2-bromophenyl)-4-chlorobutanamide

$$$$

M. F.

C10H11BrClNO

Suppliers	Catalog Number
Alfa Aesar	H59869

Database

Data ID

M. W.

276.55744

CAS

Similarity

N/A

ID: 301034

2-fluoro-N-[2-(hydroxymethyl)-5-methoxyphenyl]benzamide

$$$$

M. F.

C15H14FNO3

Suppliers	Catalog Number
Alfa Aesar	H59870

Database

Data ID

M. W.

275.2749632

CAS

198139-95-6

Similarity

N/A

ID: 301035

N-ethyl-3-methylbenzamide

$$$$

M. F.

C10H13NO

Suppliers	Catalog Number
Alfa Aesar	H59871

Database

Data ID

M. W.

163.21632

CAS

26819-07-8

Similarity

N/A

ID: 301036

N-(2-ethoxyphenyl)-3-methylbenzamide

$$$$

M. F.

C16H17NO2

Suppliers	Catalog Number
Alfa Aesar	H59872

Database

Data ID

M. W.

255.31168

CAS

Similarity

N/A

ID: 301037

4-chloro-N-(2-fluoro-4-iodophenyl)benzamide

$$$$

M. F.

C13H8ClFINO

Suppliers	Catalog Number
Alfa Aesar	H59875

Database

Data ID

M. W.

375.5645932

CAS

Similarity

N/A

ID: 301038

N-(2,5-dichlorophenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C14H11Cl2NO2

Suppliers	Catalog Number
Alfa Aesar	H59876

Database

Data ID

M. W.

296.14864

CAS

7465-94-3

Similarity

N/A

ID: 301039

N-(4-bromo-3-fluorophenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C14H11BrFNO2

Suppliers	Catalog Number
Alfa Aesar	H59877

Database

Data ID

M. W.

324.1450432

CAS

Similarity

N/A

ID: 301040

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

$$$$

M. F.

C15H13N3O5

Suppliers	Catalog Number
Alfa Aesar	H59879

Database

Data ID

M. W.

315.28082

CAS

Similarity

N/A

ID: 301041

2-[4-(difluoromethoxy)-2-fluorophenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

$$$$

M. F.

C13H16BF3O3

Suppliers	Catalog Number
Alfa Aesar	H59880

Database

Data ID

M. W.

288.0705496

CAS

Similarity

N/A

ID: 301042

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

$$$$

M. F.

C14H11F2NO

Suppliers	Catalog Number
Alfa Aesar	H59881

Database

Data ID

M. W.

247.2400464

CAS

710310-20-6

Similarity

N/A

ID: 301043

N-(3-fluoro-4-methylphenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C15H14FNO2

Suppliers	Catalog Number
Alfa Aesar	H59883

Database

Data ID

M. W.

259.2755632

CAS

327065-77-0

Similarity

N/A

ID: 301044

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

$$$$

M. F.

C13H7Cl3N2O3

Suppliers	Catalog Number
Alfa Aesar	H59884

Database

Data ID

M. W.

345.56528

CAS

Similarity

N/A

ID: 301045

N-[(4-fluorophenyl)methyl]-3-nitrobenzamide

$$$$

M. F.

C14H11FN2O3

Suppliers	Catalog Number
Alfa Aesar	H59885

Database

Data ID

M. W.

274.2471432

CAS

Similarity

N/A

ID: 301046

4-chloro-N,N-dicyclohexylbenzamide

$$$$

M. F.

C19H26ClNO

Suppliers	Catalog Number
Alfa Aesar	H59886

Database

Data ID

M. W.

319.86884

CAS

349089-31-2

Similarity

N/A

ID: 301047

2-methoxy-N-[3-(trifluoromethyl)phenyl]benzamide

$$$$

M. F.

C15H12F3NO2

Suppliers	Catalog Number
Alfa Aesar	H59888

Database

Data ID

M. W.

295.2564896

CAS

25331-53-7

Similarity

N/A

ID: 301048

2-chloro-4-nitro-N-[4-(propan-2-yl)phenyl]benzamide

$$$$

M. F.

C16H15ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59891

Database

Data ID

M. W.

318.7549

CAS

Similarity

N/A

ID: 301049

4-chloro-N-(2-fluorophenyl)butanamide

$$$$

M. F.

C10H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59892

Database

Data ID

M. W.

215.6518432

CAS

Similarity

N/A

ID: 301050

3-butyl-1-methyl-1H-imidazol-3-ium dibutyl phosphate

$$$$

M. F.

C16H33N2O4P

Suppliers	Catalog Number
Alfa Aesar	H59893

Database

Data ID

M. W.

348.417981

CAS

663199-28-8

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