4-(2-nitrophenyl)-N-(4-oxidanylbutyl)-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-(2-nitrophenyl)-N-(4-oxidanylbutyl)-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(4-hydroxybutyl)-4-(2-nitrophenyl)-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-(4-hydroxybutyl)-4-(2-nitrophenyl)-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(4-hydroxybutyl)-4-(2-nitrophenyl)-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(4-hydroxybutyl)-4-(2-nitrophenyl)-2-(trifluoromethyl)benzenesulfonamide Formula: C17H17F3N2O5S MolecularWeight: 418.38749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=C(C=C2)S(=O)(=O)NCCCCO)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=C(C=C2)S(=O)(=O)NCCCCO)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17F3N2O5S/c18-17(19,20)14-11-12(13-5-1-2-6-15(13)22(24)25)7-8-16(14)28(26,27)21-9-3-4-10-23/h1-2,5-8,11,21,23H,3-4,9-10H2