1-[(2,6-dimethoxyphenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(m-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(m-tolyl)methyl]pipecolinic acid Formula: C22H27NO4 MolecularWeight: 369.45408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=C(C=CC=C2OC)OC)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=C(C=CC=C2OC)OC)N3CCCCC3C(=O)O

InChI

InChI=1S/C22H27NO4/c1-15-8-6-9-16(14-15)21(23-13-5-4-10-17(23)22(24)25)20-18(26-2)11-7-12-19(20)27-3/h6-9,11-12,14,17,21H,4-5,10,13H2,1-3H3,(H,24,25)