1-methyl-2-oxidanyl-4-oxidanylidene-3-(4-oxidanyl-4-oxidanylidene-butanoyl)quinoline-6-carboxylic acid

Systemtic Name: 1-methyl-2-oxidanyl-4-oxidanylidene-3-(4-oxidanyl-4-oxidanylidene-butanoyl)quinoline-6-carboxylic acid Openeye Name: 2-hydroxy-3-(4-hydroxy-4-oxo-butanoyl)-1-methyl-4-oxo-quinoline-6-carboxylic acid CAS Name: 2-hydroxy-3-(4-hydroxy-1,4-dioxobutyl)-1-methyl-4-oxo-6-quinolinecarboxylic acid IUPAC Name: 2-hydroxy-3-(4-hydroxy-4-oxobutanoyl)-1-methyl-4-oxoquinoline-6-carboxylic acid Traditional Name: 2-hydroxy-3-(4-hydroxy-4-keto-butanoyl)-4-keto-1-methyl-quinoline-6-carboxylic acid Formula: C15H13NO7 MolecularWeight: 319.26622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)O)C(=O)C(=C1O)C(=O)CCC(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)O)C(=O)C(=C1O)C(=O)CCC(=O)O

InChI

InChI=1S/C15H13NO7/c1-16-9-3-2-7(15(22)23)6-8(9)13(20)12(14(16)21)10(17)4-5-11(18)19/h2-3,6,21H,4-5H2,1H3,(H,18,19)(H,22,23)