1-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(1-methyl-2-oxidanylidene-pyridin-4-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(1-methyl-2-oxo-pyridine-4-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(1-methyl-2-oxo-4-pyridinyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(1-methyl-2-oxopyridine-4-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-keto-1-methyl-isonicotinoyl)isonipecotic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CN1C=CC(=CC1=O)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C13H16N2O4/c1-14-5-2-10(8-11(14)16)12(17)15-6-3-9(4-7-15)13(18)19/h2,5,8-9H,3-4,6-7H2,1H3,(H,18,19)