N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide Formula: C20H19N3O6S2 MolecularWeight: 461.51136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N3O6S2/c1-14-6-7-17(12-15(14)2)22-30(26,27)19-10-8-16(9-11-19)21-31(28,29)20-5-3-4-18(13-20)23(24)25/h3-13,21-22H,1-2H3