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

Systemtic Name: 1-[(4-methylphenyl)-(3-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-benzyloxyphenyl)-(p-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-methylphenyl)-(3-phenylmethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylphenyl)-(3-phenylmethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-benzoxyphenyl)-(p-tolyl)methyl]pipecolinic acid Formula: C27H29NO3 MolecularWeight: 415.52406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCCCC4C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C27H29NO3/c1-20-13-15-22(16-14-20)26(28-17-6-5-12-25(28)27(29)30)23-10-7-11-24(18-23)31-19-21-8-3-2-4-9-21/h2-4,7-11,13-16,18,25-26H,5-6,12,17,19H2,1H3,(H,29,30)