2-methylpropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium

Systemtic Name: 2-methylpropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Openeye Name: isobutyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ammonium CAS Name: 2-methylpropyl-[[4-(trifluoromethylthio)phenyl]methyl]ammonium IUPAC Name: 2-methylpropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Traditional Name: isobutyl-[4-(trifluoromethylthio)benzyl]ammonium Formula: C12H17F3NS+ MolecularWeight: 264.33029

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC1=CC=C(C=C1)SC(F)(F)F

Isomeric SMILES

CC(C)C[NH2+]CC1=CC=C(C=C1)SC(F)(F)F

InChI

InChI=1S/C12H16F3NS/c1-9(2)7-16-8-10-3-5-11(6-4-10)17-12(13,14)15/h3-6,9,16H,7-8H2,1-2H3/p+1