[1-(diphenylamino)-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-(diphenylamino)-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-(diphenylcarbamoyl)propyl 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [1-oxo-1-(N-phenylanilino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(N-phenylanilino)butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid 1-(diphenylcarbamoyl)propyl ester Formula: C31H27N3O3 MolecularWeight: 489.56438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)C

InChI

InChI=1S/C31H27N3O3/c1-3-28(30(35)34(24-10-6-4-7-11-24)25-12-8-5-9-13-25)37-31(36)23-18-19-26-27(20-23)33-29(32-26)22-16-14-21(2)15-17-22/h4-20,28H,3H2,1-2H3,(H,32,33)