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

Systemtic Name: 1-[(2-phenylmethoxyphenyl)-quinolin-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2-benzyloxyphenyl)-(3-quinolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2-phenylmethoxyphenyl)-(3-quinolinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2-phenylmethoxyphenyl)-quinolin-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2-benzoxyphenyl)-(3-quinolyl)methyl]pipecolinic acid Formula: C29H28N2O3 MolecularWeight: 452.54422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C29H28N2O3/c32-29(33)26-15-8-9-17-31(26)28(23-18-22-12-4-6-14-25(22)30-19-23)24-13-5-7-16-27(24)34-20-21-10-2-1-3-11-21/h1-7,10-14,16,18-19,26,28H,8-9,15,17,20H2,(H,32,33)