4-[[4-[bis(oxidanyl)amino]phenyl]-(ethylsulfamoyl)amino]-3-nitro-N-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: 4-[[4-[bis(oxidanyl)amino]phenyl]-(ethylsulfamoyl)amino]-3-nitro-N-(phenylsulfonyl)benzenesulfonamide Openeye Name: N-(benzenesulfonyl)-4-[4-(dihydroxyamino)-N-(ethylsulfamoyl)anilino]-3-nitro-benzenesulfonamide CAS Name: N-(benzenesulfonyl)-4-[4-(dihydroxyamino)-N-(ethylsulfamoyl)anilino]-3-nitrobenzenesulfonamide IUPAC Name: N-(benzenesulfonyl)-4-[4-(dihydroxyamino)-N-(ethylsulfamoyl)anilino]-3-nitrobenzenesulfonamide Traditional Name: N-besyl-4-[4-(dihydroxyamino)-N-(ethylsulfamoyl)anilino]-3-nitro-benzenesulfonamide Formula: C20H21N5O10S3 MolecularWeight: 587.60324

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)N(C1=CC=C(C=C1)N(O)O)C2=C(C=C(C=C2)S(=O)(=O)NS(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCNS(=O)(=O)N(C1=CC=C(C=C1)N(O)O)C2=C(C=C(C=C2)S(=O)(=O)NS(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O10S3/c1-2-21-38(34,35)23(15-8-10-16(11-9-15)24(26)27)19-13-12-18(14-20(19)25(28)29)37(32,33)22-36(30,31)17-6-4-3-5-7-17/h3-14,21-22,26-27H,2H2,1H3