4-methyl-N-[(2-methylphenyl)-phenyl-methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[(2-methylphenyl)-phenyl-methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[o-tolyl(phenyl)methyl]benzenesulfonamide CAS Name: 4-methyl-N-[(2-methylphenyl)-phenylmethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[(2-methylphenyl)-phenylmethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[o-tolyl(phenyl)methyl]benzenesulfonamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O4S/c1-15-8-6-7-11-19(15)21(17-9-4-3-5-10-17)22-28(26,27)18-13-12-16(2)20(14-18)23(24)25/h3-14,21-22H,1-2H3