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

Systemtic Name: 1-[(2-methylphenyl)-quinolin-4-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[o-tolyl(4-quinolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-methylphenyl)-(4-quinolinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-methylphenyl)-quinolin-4-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[o-tolyl(4-quinolyl)methyl]isonipecotic acid Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=NC3=CC=CC=C23)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=NC3=CC=CC=C23)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C23H24N2O2/c1-16-6-2-3-7-18(16)22(25-14-11-17(12-15-25)23(26)27)20-10-13-24-21-9-5-4-8-19(20)21/h2-10,13,17,22H,11-12,14-15H2,1H3,(H,26,27)