1-[(3,5-dimethylphenyl)-pyridin-4-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,5-dimethylphenyl)-pyridin-4-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,5-dimethylphenyl)-(4-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,5-dimethylphenyl)-pyridin-4-ylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dimethylphenyl)-pyridin-4-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,5-dimethylphenyl)-(4-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=NC=C2)N3CCCCC3C(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O2/c1-14-11-15(2)13-17(12-14)19(16-6-8-21-9-7-16)22-10-4-3-5-18(22)20(23)24/h6-9,11-13,18-19H,3-5,10H2,1-2H3,(H,23,24)