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

Systemtic Name: 1-[(3-methylphenyl)-pyridin-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[m-tolyl(2-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-methylphenyl)-(2-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)-pyridin-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[m-tolyl(2-pyridyl)methyl]isonipecotic acid Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=N2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C19H22N2O2/c1-14-5-4-6-16(13-14)18(17-7-2-3-10-20-17)21-11-8-15(9-12-21)19(22)23/h2-7,10,13,15,18H,8-9,11-12H2,1H3,(H,22,23)