4-butoxy-N-[[2-fluoranyl-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-butoxy-N-[[2-fluoranyl-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-butoxy-N-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-butoxy-N-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-butoxy-N-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-butoxy-N-[2-fluoro-3-(trifluoromethyl)benzyl]benzenesulfonamide Formula: C18H19F4NO3S MolecularWeight: 405.406973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC2=C(C(=CC=C2)C(F)(F)F)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC2=C(C(=CC=C2)C(F)(F)F)F

InChI

InChI=1S/C18H19F4NO3S/c1-2-3-11-26-14-7-9-15(10-8-14)27(24,25)23-12-13-5-4-6-16(17(13)19)18(20,21)22/h4-10,23H,2-3,11-12H2,1H3