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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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