N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-2-nitro-benzenesulfonamide Openeye Name: N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-2-nitro-benzenesulfonamide CAS Name: N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-2-nitrobenzenesulfonamide Traditional Name: N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]-2-nitro-benzenesulfonamide Formula: C20H19N3O6S2 MolecularWeight: 461.51136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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