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

Systemtic Name: 1-[(2-methylphenyl)-(3-methylpyridin-4-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-methyl-4-pyridyl)-(o-tolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2-methylphenyl)-(3-methyl-4-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-methylphenyl)-(3-methylpyridin-4-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-methyl-4-pyridyl)-(o-tolyl)methyl]isonipecotic acid Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=C(C=NC=C2)C)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=C(C=NC=C2)C)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H24N2O2/c1-14-5-3-4-6-17(14)19(18-7-10-21-13-15(18)2)22-11-8-16(9-12-22)20(23)24/h3-7,10,13,16,19H,8-9,11-12H2,1-2H3,(H,23,24)