1-butyl-6-methyl-2-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-butyl-6-methyl-2-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-butyl-6-methyl-2-oxo-pyridine-3-carboxylic acid CAS Name: 1-butyl-6-methyl-2-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-butyl-6-methyl-2-oxopyridine-3-carboxylic acid Traditional Name: 1-butyl-2-keto-6-methyl-nicotinic acid Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC=C(C1=O)C(=O)O)C

Isomeric SMILES

CCCCN1C(=CC=C(C1=O)C(=O)O)C

InChI

InChI=1S/C11H15NO3/c1-3-4-7-12-8(2)5-6-9(10(12)13)11(14)15/h5-6H,3-4,7H2,1-2H3,(H,14,15)