7-(2-methylimidazol-2-yl)-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 7-(2-methylimidazol-2-yl)-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-(2-methylimidazol-2-yl)-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-(2-methyl-2-imidazolyl)-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-(2-methylimidazol-2-yl)-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 3-keto-7-(2-methylimidazol-2-yl)-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C13H9N5O5 MolecularWeight: 315.24106

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=CC=N1)C2=CC3=C(C=C2[N+](=O)[O-])NC(=O)C(=N3)C(=O)O

Isomeric SMILES

CC1(N=CC=N1)C2=CC3=C(C=C2[N+](=O)[O-])NC(=O)C(=N3)C(=O)O

InChI

InChI=1S/C13H9N5O5/c1-13(14-2-3-15-13)6-4-7-8(5-9(6)18(22)23)17-11(19)10(16-7)12(20)21/h2-5H,1H3,(H,17,19)(H,20,21)