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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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