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

Systemtic Name: 1-[(2-phenylmethoxyphenyl)-pyridin-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(2-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-phenylmethoxyphenyl)-(2-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-phenylmethoxyphenyl)-pyridin-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2-benzoxyphenyl)-(2-pyridyl)methyl]isonipecotic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=CC=CC=N4

InChI

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