4-methyl-N-[3-[(4-methylphenyl)sulfonylamino]-4-nitro-phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-[(4-methylphenyl)sulfonylamino]-4-nitro-phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-nitro-3-(p-tolylsulfonylamino)phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[3-[(4-methylphenyl)sulfonylamino]-4-nitrophenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[3-[(4-methylphenyl)sulfonylamino]-4-nitrophenyl]benzenesulfonamide Traditional Name: 4-methyl-N-[4-nitro-3-(tosylamino)phenyl]benzenesulfonamide Formula: C20H19N3O6S2 MolecularWeight: 461.51136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=C(C=C3)C

InChI

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