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

Systemtic Name: 1-[2,3-bis(oxidanylidene)-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl]ethylphosphonic acid Openeye Name: 1-(2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid CAS Name: 1-(2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid IUPAC Name: 1-(2,3-dioxo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid Traditional Name: 1-(2,3-diketo-7-sulfamoyl-4H-benzo[h]quinoxalin-1-yl)ethylphosphonic acid Formula: C14H14N3O7PS MolecularWeight: 399.315621

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C2=C(C=CC3=C2C=CC=C3S(=O)(=O)N)NC(=O)C1=O)P(=O)(O)O

Isomeric SMILES

CC(N1C2=C(C=CC3=C2C=CC=C3S(=O)(=O)N)NC(=O)C1=O)P(=O)(O)O

InChI

InChI=1S/C14H14N3O7PS/c1-7(25(20,21)22)17-12-9-3-2-4-11(26(15,23)24)8(9)5-6-10(12)16-13(18)14(17)19/h2-7H,1H3,(H,16,18)(H2,15,23,24)(H2,20,21,22)