N-(1,3-diphenylpropan-2-yl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-diphenylpropan-2-yl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(1-benzyl-2-phenyl-ethyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(1,3-diphenylpropan-2-yl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(1,3-diphenylpropan-2-yl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(1-benzyl-2-phenyl-ethyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O4S/c1-17-12-13-21(16-22(17)24(25)26)29(27,28)23-20(14-18-8-4-2-5-9-18)15-19-10-6-3-7-11-19/h2-13,16,20,23H,14-15H2,1H3