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

Systemtic Name: 1-[(1-ethylbenzimidazol-2-yl)-(4-methoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-ethylbenzimidazol-2-yl)-(4-methoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-ethyl-2-benzimidazolyl)-(4-methoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-ethylbenzimidazol-2-yl)-(4-methoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-ethylbenzimidazol-2-yl)-(4-methoxyphenyl)methyl]isonipecotic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3/c1-3-26-20-7-5-4-6-19(20)24-22(26)21(16-8-10-18(29-2)11-9-16)25-14-12-17(13-15-25)23(27)28/h4-11,17,21H,3,12-15H2,1-2H3,(H,27,28)