2-[6-nitro-2,3-bis(oxidanylidene)-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl]ethanoic acid

Systemtic Name: 2-[6-nitro-2,3-bis(oxidanylidene)-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl]ethanoic acid Openeye Name: 2-(6-nitro-2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)acetic acid CAS Name: 2-(6-nitro-2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)acetic acid IUPAC Name: 2-(6-nitro-2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)acetic acid Traditional Name: 2-(2,3-diketo-6-nitro-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)acetic acid Formula: C14H10N4O8S MolecularWeight: 394.3162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)N)[N+](=O)[O-])NC(=O)C(=O)N3CC(=O)O

Isomeric SMILES

C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)N)[N+](=O)[O-])NC(=O)C(=O)N3CC(=O)O

InChI

InChI=1S/C14H10N4O8S/c15-27(25,26)9-3-1-2-6-11(9)8(18(23)24)4-7-12(6)17(5-10(19)20)14(22)13(21)16-7/h1-4H,5H2,(H,16,21)(H,19,20)(H2,15,25,26)