1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperidine-3-carboxylic acid Openeye Name: 1-(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(2-keto-4,6-dimethyl-1H-pyridine-3-carbonyl)nipecotic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)C(=O)N2CCCC(C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)C(=O)N2CCCC(C2)C(=O)O)C

InChI

InChI=1S/C14H18N2O4/c1-8-6-9(2)15-12(17)11(8)13(18)16-5-3-4-10(7-16)14(19)20/h6,10H,3-5,7H2,1-2H3,(H,15,17)(H,19,20)