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

Systemtic Name: 1-[1-(3-phenoxyphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(3-phenoxyphenyl)-2-(2-pyridyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(3-phenoxyphenyl)-2-(2-pyridinyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-phenoxyphenyl)-2-pyridin-2-ylethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(3-phenoxyphenyl)-2-(2-pyridyl)ethyl]pipecolinic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

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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)OC4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(CC2=CC=CC=N2)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3/c28-25(29)23-14-5-7-16-27(23)24(18-20-10-4-6-15-26-20)19-9-8-13-22(17-19)30-21-11-2-1-3-12-21/h1-4,6,8-13,15,17,23-24H,5,7,14,16,18H2,(H,28,29)