1-[1-(3-phenylmethoxyphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[1-(3-phenylmethoxyphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(3-benzyloxyphenyl)-2-(2-pyridyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(3-phenylmethoxyphenyl)-2-(2-pyridinyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-phenylmethoxyphenyl)-2-pyridin-2-ylethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(3-benzoxyphenyl)-2-(2-pyridyl)ethyl]pipecolinic acid Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(CC2=CC=CC=N2)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(CC2=CC=CC=N2)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O3/c29-26(30)24-14-5-7-16-28(24)25(18-22-12-4-6-15-27-22)21-11-8-13-23(17-21)31-19-20-9-2-1-3-10-20/h1-4,6,8-13,15,17,24-25H,5,7,14,16,18-19H2,(H,29,30)