(3E)-3-[(carboxymethylamino)-oxidanyl-methylidene]-2,4-bis(oxidanylidene)-1H-quinoline-6-carboxylic acid

Systemtic Name: (3E)-3-[(carboxymethylamino)-oxidanyl-methylidene]-2,4-bis(oxidanylidene)-1H-quinoline-6-carboxylic acid Openeye Name: (3E)-3-[(carboxymethylamino)-hydroxy-methylene]-2,4-dioxo-1H-quinoline-6-carboxylic acid CAS Name: (3E)-3-[(carboxymethylamino)-hydroxymethylidene]-2,4-dioxo-1H-quinoline-6-carboxylic acid IUPAC Name: (3E)-3-[(carboxymethylamino)-hydroxymethylidene]-2,4-dioxo-1H-quinoline-6-carboxylic acid Traditional Name: (3E)-3-[(carboxymethylamino)-hydroxy-methylene]-2,4-diketo-1H-quinoline-6-carboxylic acid Formula: C13H10N2O7 MolecularWeight: 306.2277

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)C(=O)C(=C(NCC(=O)O)O)C(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)C(=O)/C(=C(/NCC(=O)O)\O)/C(=O)N2

InChI

InChI=1S/C13H10N2O7/c16-8(17)4-14-11(19)9-10(18)6-3-5(13(21)22)1-2-7(6)15-12(9)20/h1-3,14,19H,4H2,(H,15,20)(H,16,17)(H,21,22)/b11-9+