1-[(3-methoxyphenyl)-pyridin-4-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)-pyridin-4-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-methoxyphenyl)-(4-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-pyridin-4-ylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)-pyridin-4-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-methoxyphenyl)-(4-pyridyl)methyl]isonipecotic acid Formula: C19H22N2O3 MolecularWeight: 326.38958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=CC=NC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=CC=NC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C19H22N2O3/c1-24-17-4-2-3-16(13-17)18(14-5-9-20-10-6-14)21-11-7-15(8-12-21)19(22)23/h2-6,9-10,13,15,18H,7-8,11-12H2,1H3,(H,22,23)