1-cyclopentyl-2-[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]benzimidazole-5-carboxylic acid Openeye Name: 2-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-1-cyclopentyl-benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-1-cyclopentylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-1-cyclopentyl-benzimidazole-5-carboxylic acid Formula: C31H32N4O3 MolecularWeight: 508.61078

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)N5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)N5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C31H32N4O3/c36-30(34-18-16-33(17-19-34)21-22-6-2-1-3-7-22)24-12-10-23(11-13-24)29-32-27-20-25(31(37)38)14-15-28(27)35(29)26-8-4-5-9-26/h1-3,6-7,10-15,20,26H,4-5,8-9,16-19,21H2,(H,37,38)