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

Systemtic Name: 1-[6-nitro-2,3-bis(oxidanylidene)-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl]ethylphosphonic acid Openeye Name: 1-(6-nitro-2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid CAS Name: 1-(6-nitro-2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid IUPAC Name: 1-(6-nitro-2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid Traditional Name: 1-(2,3-diketo-6-nitro-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid Formula: C14H13N4O9PS MolecularWeight: 444.313181

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C2=C3C=CC=C(C3=C(C=C2NC(=O)C1=O)[N+](=O)[O-])S(=O)(=O)N)P(=O)(O)O

Isomeric SMILES

CC(N1C2=C3C=CC=C(C3=C(C=C2NC(=O)C1=O)[N+](=O)[O-])S(=O)(=O)N)P(=O)(O)O

InChI

InChI=1S/C14H13N4O9PS/c1-6(28(23,24)25)17-12-7-3-2-4-10(29(15,26)27)11(7)9(18(21)22)5-8(12)16-13(19)14(17)20/h2-6H,1H3,(H,16,19)(H2,15,26,27)(H2,23,24,25)