[1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(2,4-dimethylphenyl)carbamoyl]propyl 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid [1-(2,4-dimethylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,4-dimethylanilino)-1-oxobutan-2-yl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid 1-[(2,4-dimethylphenyl)carbamoyl]propyl ester Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)C)C)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)C)C)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H27N3O4/c1-5-24(26(31)30-21-12-6-16(2)14-17(21)3)34-27(32)19-9-13-22-23(15-19)29-25(28-22)18-7-10-20(33-4)11-8-18/h6-15,24H,5H2,1-4H3,(H,28,29)(H,30,31)