1-butyl-2,6-dimethyl-4-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-butyl-2,6-dimethyl-4-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-butyl-2,6-dimethyl-4-oxo-pyridine-3-carboxylic acid CAS Name: 1-butyl-2,6-dimethyl-4-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-butyl-2,6-dimethyl-4-oxopyridine-3-carboxylic acid Traditional Name: 1-butyl-4-keto-2,6-dimethyl-nicotinic acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=O)C(=C1C)C(=O)O)C

Isomeric SMILES

CCCCN1C(=CC(=O)C(=C1C)C(=O)O)C

InChI

InChI=1S/C12H17NO3/c1-4-5-6-13-8(2)7-10(14)11(9(13)3)12(15)16/h7H,4-6H2,1-3H3,(H,15,16)