Chembase list of 866358 unique molecular structures

4-chloro-3-nitro-N,N-bis(propan-2-yl)benzamide

$$$$

M. F.

C13H17ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59894

Database

Data ID

M. W.

284.73868

CAS

Similarity

N/A

ID: 301052

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

$$$$

M. F.

C14H10ClFN2O3

Suppliers	Catalog Number
Alfa Aesar	H59895

Database

Data ID

M. W.

308.6922032

CAS

Similarity

N/A

ID: 301053

N-(3,4-difluorophenyl)-3-methylbenzamide

$$$$

M. F.

C14H11F2NO

Suppliers	Catalog Number
Alfa Aesar	H59900

Database

Data ID

M. W.

247.2400464

CAS

346720-59-0

Similarity

N/A

ID: 301054

N-benzyl-2-chloro-N-phenylbenzamide

$$$$

M. F.

C20H16ClNO

Suppliers	Catalog Number
Alfa Aesar	H59901

Database

Data ID

M. W.

321.80014

CAS

500873-57-4

Similarity

N/A

ID: 301055

N-cyclopentyl-2,6-difluorobenzamide

$$$$

M. F.

C12H13F2NO

Suppliers	Catalog Number
Alfa Aesar	H59902

Database

Data ID

M. W.

225.2345264

CAS

Similarity

N/A

ID: 301056

3-nitro-N,N-bis(propan-2-yl)benzamide

$$$$

M. F.

C13H18N2O3

Suppliers	Catalog Number
Alfa Aesar	H59903

Database

Data ID

M. W.

250.29362

CAS

Similarity

N/A

ID: 301057

4-bromo-3,5-difluorobenzoic acid

$$$$

M. F.

C7H3BrF2O2

Suppliers	Catalog Number
Alfa Aesar	H59904

Database

Data ID

M. W.

236.9983264

CAS

Similarity

N/A

ID: 301058

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

$$$$

M. F.

C15H13ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59905

Database

Data ID

M. W.

304.72832

CAS

Similarity

N/A

ID: 301059

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

$$$$

M. F.

C15H14ClNO3

Suppliers	Catalog Number
Alfa Aesar	H59906

Database

Data ID

M. W.

291.72956

CAS

196938-30-4

Similarity

N/A

ID: 301060

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

$$$$

M. F.

C14H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59908

Database

Data ID

M. W.

263.6946432

CAS

Similarity

N/A

ID: 301061

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

$$$$

M. F.

C16H17NO2

Suppliers	Catalog Number
Alfa Aesar	H59909

Database

Data ID

M. W.

255.31168

CAS

Similarity

N/A

ID: 301062

4-chloro-N-(5-chloro-2-methylphenyl)benzamide

$$$$

M. F.

C14H11Cl2NO

Suppliers	Catalog Number
Alfa Aesar	H59910

Database

Data ID

M. W.

280.14924

CAS

301159-93-3

Similarity

N/A

ID: 301063

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

$$$$

M. F.

C14H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59912

Database

Data ID

M. W.

263.6946432

CAS

528844-84-0

Similarity

N/A

ID: 301064

2-chloro-4-nitro-N,N-bis(propan-2-yl)benzamide

$$$$

M. F.

C13H17ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59913

Database

Data ID

M. W.

284.73868

CAS

Similarity

N/A

ID: 301065

2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide

$$$$

M. F.

C14H9ClF3NO

Suppliers	Catalog Number
Alfa Aesar	H59914

Database

Data ID

M. W.

299.6755696

CAS

3873-79-8

Similarity

N/A

ID: 301066

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

$$$$

M. F.

C13H8ClFN2O3

Suppliers	Catalog Number
Alfa Aesar	H59915

Database

Data ID

M. W.

294.6656232

CAS

Similarity

N/A

ID: 301067

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

$$$$

M. F.

C15H13N3O5

Suppliers	Catalog Number
Alfa Aesar	H59918

Database

Data ID

M. W.

315.28082

CAS

Similarity

N/A

ID: 301068

N-(4-ethylphenyl)-2-methoxybenzamide

$$$$

M. F.

C16H17NO2

Suppliers	Catalog Number
Alfa Aesar	H59920

Database

Data ID

M. W.

255.31168

CAS

418777-17-0

Similarity

N/A

ID: 301069

3-fluoro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

$$$$

M. F.

C13H17BFNO3

Suppliers	Catalog Number
Alfa Aesar	H59922

Database

Data ID

M. W.

265.0883832

CAS

Similarity

N/A

ID: 301070

N-ethyl-4-(hydroxymethyl)benzamide

$$$$

M. F.

C10H13NO2

Suppliers	Catalog Number
Alfa Aesar	H59924

Database

Data ID

M. W.

179.21572

CAS

7403-41-0

Similarity

N/A

ID: 301071

N-benzyl-2,6-difluoro-N-phenylbenzamide

$$$$

M. F.

C20H15F2NO

Suppliers	Catalog Number
Alfa Aesar	H59925

Database

Data ID

M. W.

323.3360064

CAS

Similarity

N/A

ID: 301072

3-benzyl-1-(4-fluorophenyl)urea

$$$$

M. F.

C14H13FN2O

Suppliers	Catalog Number
Alfa Aesar	H59926

Database

Data ID

M. W.

244.2642232

CAS

Similarity

N/A

ID: 301073

N,N-dibutyl-4-chloro-3-nitrobenzamide

$$$$

M. F.

C15H21ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59927

Database

Data ID

M. W.

312.79184

CAS

Similarity

N/A

ID: 301074

1-[3-fluoro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoyl]-4-methylpiperazine

$$$$

M. F.

C18H26BFN2O3

Suppliers	Catalog Number
Alfa Aesar	H59929

Database

Data ID

M. W.

348.2200432

CAS

Similarity

N/A

ID: 301075

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

$$$$

M. F.

C14H11BrFNO2

Suppliers	Catalog Number
Alfa Aesar	H59930

Database

Data ID

M. W.

324.1450432

CAS

420092-67-7

Similarity

N/A

ID: 301076

1-bromo-4-(difluoromethoxy)-2-fluorobenzene

$$$$

M. F.

C7H4BrF3O

Suppliers	Catalog Number
Alfa Aesar	H59931

Database

Data ID

M. W.

241.0052696

CAS

Similarity

N/A

ID: 301077

3-fluoro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

$$$$

M. F.

C13H16BFO3

Suppliers	Catalog Number
Alfa Aesar	H59933

Database

Data ID

M. W.

250.0737432

CAS

Similarity

N/A

ID: 301078

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

$$$$

M. F.

C13H8ClFN2O3

Suppliers	Catalog Number
Alfa Aesar	H59934

Database

Data ID

M. W.

294.6656232

CAS

Similarity

N/A

ID: 301079

2-chloro-N-(3,5-dichlorophenyl)benzamide

$$$$

M. F.

C13H8Cl3NO

Suppliers	Catalog Number
Alfa Aesar	H59936

Database

Data ID

M. W.

300.56772

CAS

83426-50-0

Similarity

N/A

ID: 301080

4-(hydroxymethyl)-N-(propan-2-yl)benzamide

$$$$

M. F.

C11H15NO2

Suppliers	Catalog Number
Alfa Aesar	H59937

Database

Data ID

M. W.

193.2423

CAS

7464-44-0

Similarity

N/A

ID: 301081

N-(3,4-dimethoxyphenyl)-4-(hydroxymethyl)benzamide

$$$$

M. F.

C16H17NO4

Suppliers	Catalog Number
Alfa Aesar	H59938

Database

Data ID

M. W.

287.31048

CAS

156086-12-3

Similarity

N/A

ID: 301082

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

$$$$

M. F.

C13H8BrClN2O3

Suppliers	Catalog Number
ChemBridge	5259222
Alfa Aesar	H59939

Database

Data ID

M. W.

355.57122

CAS

349619-73-4

Similarity

N/A

ID: 301083

3-methyl-N-propylbenzamide

$$$$

M. F.

C11H15NO

Suppliers	Catalog Number
Alfa Aesar	H59940

Database

Data ID

M. W.

177.2429

CAS

330466-42-7

Similarity

N/A

ID: 301084

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

$$$$

M. F.

C13H7F2N3O5

Suppliers	Catalog Number
Alfa Aesar	H59941

Database

Data ID

M. W.

323.2085864

CAS

Similarity

N/A

ID: 301085

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

$$$$

M. F.

C14H11F2NO2

Suppliers	Catalog Number
Alfa Aesar	H59942

Database

Data ID

M. W.

263.2394464

CAS

314022-67-8

Similarity

N/A

ID: 301086

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

$$$$

M. F.

C15H14ClNO3

Suppliers	Catalog Number
Alfa Aesar	H59943

Database

Data ID

M. W.

291.72956

CAS

339297-91-5

Similarity

N/A

ID: 301087

[2-amino-4-fluoro-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanol

$$$$

M. F.

C13H19BFNO3

Suppliers	Catalog Number
Alfa Aesar	H59944

Database

Data ID

M. W.

267.1042632

CAS

Similarity

N/A

ID: 301088

N-benzyl-2-methoxy-N-(propan-2-yl)benzamide

$$$$

M. F.

C18H21NO2

Suppliers	Catalog Number
Alfa Aesar	H59945

Database

Data ID

M. W.

283.36484

CAS

552854-67-8

Similarity

N/A

ID: 301089

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

$$$$

M. F.

C13H8ClN3O5

Suppliers	Catalog Number
Alfa Aesar	H59946

Database

Data ID

M. W.

321.67272

CAS

Similarity

N/A

ID: 301090

N-(2,5-difluorophenyl)-3-methylbenzamide

$$$$

M. F.

C14H11F2NO

Suppliers	Catalog Number
Alfa Aesar	H59947

Database

Data ID

M. W.

247.2400464

CAS

1002813-62-8

Similarity

N/A

ID: 301091

2-chloro-N,N-dimethylbenzamide

$$$$

M. F.

C9H10ClNO

Suppliers	Catalog Number
Alfa Aesar	H59948

Database

Data ID

M. W.

183.6348

CAS

6526-67-6

Similarity

N/A

ID: 301092

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

$$$$

M. F.

C15H13ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59949

Database

Data ID

M. W.

304.72832

CAS

Similarity

N/A

ID: 301093

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

$$$$

M. F.

C14H11ClFNO

Suppliers	Catalog Number
Alfa Aesar	H59950

Database

Data ID

M. W.

263.6946432

CAS

528835-13-4

Similarity

N/A

ID: 301094

2-chloro-N-(4-ethylphenyl)-4-nitrobenzamide

$$$$

M. F.

C15H13ClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59951

Database

Data ID

M. W.

304.72832

CAS

Similarity

N/A

ID: 301095

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

$$$$

M. F.

C13H8BrClN2O3

Suppliers	Catalog Number
Alfa Aesar	H59952

Database

Data ID

M. W.

355.57122

CAS

Similarity

N/A

ID: 301096

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

$$$$

M. F.

C13H7Cl3N2O3

Suppliers	Catalog Number
Alfa Aesar	H59953

Database

Data ID

M. W.

345.56528

CAS

Similarity

N/A

ID: 301097

N-(5-chloro-2-methylphenyl)-2-methoxybenzamide

$$$$

M. F.

C15H14ClNO2

Suppliers	Catalog Number
Alfa Aesar	H59954

Database

Data ID

M. W.

275.73016

CAS

331436-20-5

Similarity

N/A

ID: 301098

N-(2,6-dichlorophenyl)-3-methylbenzamide

$$$$

M. F.

C14H11Cl2NO

Suppliers	Catalog Number
Alfa Aesar	H59955

Database

Data ID

M. W.

280.14924

CAS

157491-15-1

Similarity

N/A

ID: 301099

1-(benzyloxy)-3-chloro-2-fluorobenzene

$$$$

M. F.

C13H10ClFO

Suppliers	Catalog Number
Alfa Aesar	H59956

Database

Data ID

M. W.

236.6693032

CAS

Similarity

N/A

ID: 301100

4-chloro-N-cyclohexyl-N-methylbutanamide

$$$$

M. F.

C11H20ClNO

Suppliers	Catalog Number
Alfa Aesar	H59957

Database

Data ID

M. W.

217.7356

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