2-methyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-5-nitro-benzenesulfonamide Openeye Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-5-nitrobenzenesulfonamide IUPAC Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C21H21N3O6S2 MolecularWeight: 475.53794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O6S2/c1-16-8-11-19(24(25)26)14-21(16)31(27,28)22-18-9-12-20(13-10-18)32(29,30)23(2)15-17-6-4-3-5-7-17/h3-14,22H,15H2,1-2H3