1-methyl-4-oxidanylidene-quinoline-3,7-dicarboxylic acid

Systemtic Name: 1-methyl-4-oxidanylidene-quinoline-3,7-dicarboxylic acid Openeye Name: 1-methyl-4-oxo-quinoline-3,7-dicarboxylic acid CAS Name: 1-methyl-4-oxoquinoline-3,7-dicarboxylic acid IUPAC Name: 1-methyl-4-oxoquinoline-3,7-dicarboxylic acid Traditional Name: 4-keto-1-methyl-quinoline-3,7-dicarboxylic acid Formula: C12H9NO5 MolecularWeight: 247.20356

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C12H9NO5/c1-13-5-8(12(17)18)10(14)7-3-2-6(11(15)16)4-9(7)13/h2-5H,1H3,(H,15,16)(H,17,18)