1-[(1-ethylbenzimidazol-2-yl)-(3-methylphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-ethylbenzimidazol-2-yl)-(3-methylphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-ethylbenzimidazol-2-yl)-(m-tolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-ethyl-2-benzimidazolyl)-(3-methylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-ethylbenzimidazol-2-yl)-(3-methylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-ethylbenzimidazol-2-yl)-(m-tolyl)methyl]isonipecotic acid Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C(C3=CC=CC(=C3)C)N4CCC(CC4)C(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C(C3=CC=CC(=C3)C)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C23H27N3O2/c1-3-26-20-10-5-4-9-19(20)24-22(26)21(18-8-6-7-16(2)15-18)25-13-11-17(12-14-25)23(27)28/h4-10,15,17,21H,3,11-14H2,1-2H3,(H,27,28)