1-[(3,5-dimethylphenyl)-pyridin-2-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethylphenyl)-pyridin-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,5-dimethylphenyl)-(2-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethylphenyl)-(2-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethylphenyl)-pyridin-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,5-dimethylphenyl)-(2-pyridyl)methyl]pipecolinic acid Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=CC=CC=N2)N3CCCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=CC=CC=N2)N3CCCCC3C(=O)O)C

InChI

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