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

Systemtic Name: 1-[(3-phenylmethoxyphenyl)-pyridin-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-(2-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-phenylmethoxyphenyl)-(2-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenylmethoxyphenyl)-pyridin-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-(2-pyridyl)methyl]pipecolinic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=N4

InChI

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