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

Systemtic Name: [1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-(2-naphthylcarbamoyl)propyl 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [1-(2-naphthalenylamino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(naphthalen-2-ylamino)-1-oxobutan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid 1-(2-naphthylcarbamoyl)propyl ester Formula: C29H25N3O3 MolecularWeight: 463.5271

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)C

InChI

InChI=1S/C29H25N3O3/c1-3-26(28(33)30-23-14-12-19-6-4-5-7-21(19)16-23)35-29(34)22-13-15-24-25(17-22)32-27(31-24)20-10-8-18(2)9-11-20/h4-17,26H,3H2,1-2H3,(H,30,33)(H,31,32)