2,4-bis(azanyl)-5-[(3,5-dinitro-2-oxidanidyl-phenyl)diazenyl]benzenesulfonate

Systemtic Name: 2,4-bis(azanyl)-5-[(3,5-dinitro-2-oxidanidyl-phenyl)diazenyl]benzenesulfonate Openeye Name: 2,4-diamino-5-(3,5-dinitro-2-oxido-phenyl)azo-benzenesulfonate CAS Name: 2,4-diamino-5-(3,5-dinitro-2-oxidophenyl)azobenzenesulfonate IUPAC Name: 2,4-diamino-5-[(3,5-dinitro-2-oxidophenyl)diazenyl]benzenesulfonate Traditional Name: 2,4-diamino-5-(3,5-dinitro-2-oxido-phenyl)azo-besylate Formula: C12H8N6O8S-2 MolecularWeight: 396.29232

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N=NC2=CC(=C(C=C2N)N)S(=O)(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N=NC2=CC(=C(C=C2N)N)S(=O)(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10N6O8S/c13-6-3-7(14)11(27(24,25)26)4-8(6)15-16-9-1-5(17(20)21)2-10(12(9)19)18(22)23/h1-4,19H,13-14H2,(H,24,25,26)/p-2