N-(4-butylphenyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-butylphenyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(4-butylphenyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(4-butylphenyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(4-butylphenyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(4-butylphenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C17H20N2O4S MolecularWeight: 348.4167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O4S/c1-3-4-5-14-7-9-15(10-8-14)18-24(22,23)16-11-6-13(2)17(12-16)19(20)21/h6-12,18H,3-5H2,1-2H3