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

Systemtic Name: 1-[(4-methylphenyl)-pyridin-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[p-tolyl(2-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methylphenyl)-(2-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methylphenyl)-pyridin-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[p-tolyl(2-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=CC=CC=N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

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

InChI

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