N-(4-methyl-3-nitro-phenyl)-4-(2-methylpropyl)benzenesulfonamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-4-(2-methylpropyl)benzenesulfonamide Openeye Name: 4-isobutyl-N-(4-methyl-3-nitro-phenyl)benzenesulfonamide CAS Name: N-(4-methyl-3-nitrophenyl)-4-(2-methylpropyl)benzenesulfonamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-4-(2-methylpropyl)benzenesulfonamide Traditional Name: 4-isobutyl-N-(4-methyl-3-nitro-phenyl)benzenesulfonamide Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O4S/c1-12(2)10-14-5-8-16(9-6-14)24(22,23)18-15-7-4-13(3)17(11-15)19(20)21/h4-9,11-12,18H,10H2,1-3H3