3-nitro-4-[(2-nitro-4-sulfamoyl-phenyl)disulfanyl]benzenesulfonamide

Systemtic Name: 3-nitro-4-[(2-nitro-4-sulfamoyl-phenyl)disulfanyl]benzenesulfonamide Openeye Name: 3-nitro-4-[(2-nitro-4-sulfamoyl-phenyl)disulfanyl]benzenesulfonamide CAS Name: 3-nitro-4-[(2-nitro-4-sulfamoylphenyl)disulfanyl]benzenesulfonamide IUPAC Name: 3-nitro-4-[(2-nitro-4-sulfamoylphenyl)disulfanyl]benzenesulfonamide Traditional Name: 3-nitro-4-[(2-nitro-4-sulfamoyl-phenyl)disulfanyl]benzenesulfonamide Formula: C12H10N4O8S4 MolecularWeight: 466.4898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])SSC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])SSC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H10N4O8S4/c13-27(21,22)7-1-3-11(9(5-7)15(17)18)25-26-12-4-2-8(28(14,23)24)6-10(12)16(19)20/h1-6H,(H2,13,21,22)(H2,14,23,24)