1-[(3-methylpyridin-2-yl)-pyridin-3-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-methylpyridin-2-yl)-pyridin-3-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-methyl-2-pyridyl)-(3-pyridyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-methyl-2-pyridinyl)-(3-pyridinyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-methylpyridin-2-yl)-pyridin-3-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3-methyl-2-pyridyl)-(3-pyridyl)methyl]nipecotic acid Formula: C18H21N3O2 MolecularWeight: 311.37824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CN=CC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CN=CC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C18H21N3O2/c1-13-5-2-9-20-16(13)17(14-6-3-8-19-11-14)21-10-4-7-15(12-21)18(22)23/h2-3,5-6,8-9,11,15,17H,4,7,10,12H2,1H3,(H,22,23)