1-[(4-methylphenyl)-(6-methylpyridin-2-yl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-methylphenyl)-(6-methylpyridin-2-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(6-methyl-2-pyridyl)-(p-tolyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-methylphenyl)-(6-methyl-2-pyridinyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylphenyl)-(6-methylpyridin-2-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(6-methyl-2-pyridyl)-(p-tolyl)methyl]nipecotic acid Formula: C20H24N2O2 MolecularWeight: 324.41676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC(=N2)C)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC(=N2)C)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C20H24N2O2/c1-14-8-10-16(11-9-14)19(18-7-3-5-15(2)21-18)22-12-4-6-17(13-22)20(23)24/h3,5,7-11,17,19H,4,6,12-13H2,1-2H3,(H,23,24)