3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C24H27N3O4/c1-17-7-2-3-8-19(17)22(28)26-14-11-18(12-15-26)23(29)31-16-6-13-27-21-10-5-4-9-20(21)25-24(27)30/h2-5,7-10,18H,6,11-16H2,1H3,(H,25,30)