4-methyl-N-[1-(4-methylphenyl)propyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[1-(4-methylphenyl)propyl]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[1-(p-tolyl)propyl]benzenesulfonamide CAS Name: 4-methyl-N-[1-(4-methylphenyl)propyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[1-(4-methylphenyl)propyl]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[1-(p-tolyl)propyl]benzenesulfonamide Formula: C17H20N2O4S MolecularWeight: 348.4167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O4S/c1-4-16(14-8-5-12(2)6-9-14)18-24(22,23)15-10-7-13(3)17(11-15)19(20)21/h5-11,16,18H,4H2,1-3H3