1-[(3-methoxyphenyl)-[1-(phenylmethyl)imidazol-2-yl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)-[1-(phenylmethyl)imidazol-2-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-benzylimidazol-2-yl)-(3-methoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-[1-(phenylmethyl)-2-imidazolyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-benzylimidazol-2-yl)-(3-methoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-benzylimidazol-2-yl)-(3-methoxyphenyl)methyl]isonipecotic acid Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=NC=CN2CC3=CC=CC=C3)N4CCC(CC4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=NC=CN2CC3=CC=CC=C3)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C24H27N3O3/c1-30-21-9-5-8-20(16-21)22(26-13-10-19(11-14-26)24(28)29)23-25-12-15-27(23)17-18-6-3-2-4-7-18/h2-9,12,15-16,19,22H,10-11,13-14,17H2,1H3,(H,28,29)