[6-nitro-2,3-bis(oxidanylidene)-9-sulfamoyl-4H-benzo[h]quinoxalin-1-yl]methylphosphonic acid

Systemtic Name: [6-nitro-2,3-bis(oxidanylidene)-9-sulfamoyl-4H-benzo[h]quinoxalin-1-yl]methylphosphonic acid Openeye Name: (6-nitro-2,3-dioxo-9-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid CAS Name: (6-nitro-2,3-dioxo-9-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid IUPAC Name: (6-nitro-2,3-dioxo-9-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid Traditional Name: (2,3-diketo-6-nitro-9-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)methylphosphonic acid Formula: C13H11N4O9PS MolecularWeight: 430.286601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C3C(=C2C=C1S(=O)(=O)N)N(C(=O)C(=O)N3)CP(=O)(O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C3C(=C2C=C1S(=O)(=O)N)N(C(=O)C(=O)N3)CP(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H11N4O9PS/c14-28(25,26)6-1-2-7-8(3-6)11-9(4-10(7)17(20)21)15-12(18)13(19)16(11)5-27(22,23)24/h1-4H,5H2,(H,15,18)(H2,14,25,26)(H2,22,23,24)