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

Systemtic Name: 1-[(4-dimethylaminophenyl)-(1-ethylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-dimethylaminophenyl)-(1-ethylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-dimethylaminophenyl)-(1-ethyl-2-benzimidazolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-dimethylaminophenyl)-(1-ethylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-dimethylaminophenyl)-(1-ethylbenzimidazol-2-yl)methyl]isonipecotic acid Formula: C24H30N4O2 MolecularWeight: 406.5206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O2/c1-4-28-21-8-6-5-7-20(21)25-23(28)22(17-9-11-19(12-10-17)26(2)3)27-15-13-18(14-16-27)24(29)30/h5-12,18,22H,4,13-16H2,1-3H3,(H,29,30)