N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[2,5-dimethyl-4-(p-tolylsulfonylamino)phenyl]-2-methyl-4-nitro-benzenesulfonamide CAS Name: N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[2,5-dimethyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-2-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[2,5-dimethyl-4-(tosylamino)phenyl]-2-methyl-4-nitro-benzenesulfonamide Formula: C22H23N3O6S2 MolecularWeight: 489.56452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O6S2/c1-14-5-8-19(9-6-14)32(28,29)23-20-12-16(3)21(13-15(20)2)24-33(30,31)22-10-7-18(25(26)27)11-17(22)4/h5-13,23-24H,1-4H3