4-methyl-3-nitro-N,N-bis(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N,N-bis(phenylmethyl)benzenesulfonamide Openeye Name: N,N-dibenzyl-4-methyl-3-nitro-benzenesulfonamide CAS Name: 4-methyl-3-nitro-N,N-bis(phenylmethyl)benzenesulfonamide IUPAC Name: N,N-dibenzyl-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N,N-dibenzyl-4-methyl-3-nitro-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)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O4S/c1-17-12-13-20(14-21(17)23(24)25)28(26,27)22(15-18-8-4-2-5-9-18)16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3