4-(butylamino)-5-ethanoyl-6-oxidanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 4-(butylamino)-5-ethanoyl-6-oxidanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 5-acetyl-4-(butylamino)-6-oxo-1H-pyridine-3-carboxylic acid CAS Name: 5-acetyl-4-(butylamino)-6-oxo-1H-pyridine-3-carboxylic acid IUPAC Name: 5-acetyl-4-(butylamino)-6-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 5-acetyl-4-(butylamino)-6-keto-1H-pyridine-3-carboxylic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)NC=C1C(=O)O)C(=O)C

Isomeric SMILES

CCCCNC1=C(C(=O)NC=C1C(=O)O)C(=O)C

InChI

InChI=1S/C12H16N2O4/c1-3-4-5-13-10-8(12(17)18)6-14-11(16)9(10)7(2)15/h6H,3-5H2,1-2H3,(H,17,18)(H2,13,14,16)