N-(3-methyl-1-phenyl-butyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(3-methyl-1-phenyl-butyl)-3-nitro-benzenesulfonamide Openeye Name: N-(3-methyl-1-phenyl-butyl)-3-nitro-benzenesulfonamide CAS Name: N-(3-methyl-1-phenylbutyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(3-methyl-1-phenylbutyl)-3-nitrobenzenesulfonamide Traditional Name: N-(3-methyl-1-phenyl-butyl)-3-nitro-benzenesulfonamide Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O4S/c1-13(2)11-17(14-7-4-3-5-8-14)18-24(22,23)16-10-6-9-15(12-16)19(20)21/h3-10,12-13,17-18H,11H2,1-2H3