2-[(1-methyl-6-nitro-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(1-methyl-6-nitro-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(2-hydroxy-1-methyl-6-nitro-4-oxo-quinoline-3-carbonyl)amino]acetic acid CAS Name: 2-[[(2-hydroxy-1-methyl-6-nitro-4-oxo-3-quinolinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(2-hydroxy-1-methyl-6-nitro-4-oxoquinoline-3-carbonyl)amino]acetic acid Traditional Name: 2-[(2-hydroxy-4-keto-1-methyl-6-nitro-quinoline-3-carbonyl)amino]acetic acid Formula: C13H11N3O7 MolecularWeight: 321.24234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C(=C1O)C(=O)NCC(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C(=C1O)C(=O)NCC(=O)O

InChI

InChI=1S/C13H11N3O7/c1-15-8-3-2-6(16(22)23)4-7(8)11(19)10(13(15)21)12(20)14-5-9(17)18/h2-4,21H,5H2,1H3,(H,14,20)(H,17,18)