1-[(4-phenylmethoxyphenyl)-pyridin-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4-phenylmethoxyphenyl)-pyridin-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxyphenyl)-(3-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-phenylmethoxyphenyl)-(3-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-phenylmethoxyphenyl)-pyridin-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-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=C(C=C2)OCC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

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

InChI

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