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

Systemtic Name: 1-[(3,4-dimethoxyphenyl)-(4-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)-(p-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,4-dimethoxyphenyl)-(4-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)-(4-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,4-dimethoxyphenyl)-(p-tolyl)methyl]pipecolinic acid Formula: C22H27NO4 MolecularWeight: 369.45408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC(=C(C=C2)OC)OC)N3CCCCC3C(=O)O

InChI

InChI=1S/C22H27NO4/c1-15-7-9-16(10-8-15)21(23-13-5-4-6-18(23)22(24)25)17-11-12-19(26-2)20(14-17)27-3/h7-12,14,18,21H,4-6,13H2,1-3H3,(H,24,25)