3-methylsulfanylpropyl-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: 3-methylsulfanylpropyl-[[3-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: 3-methylsulfanylpropyl-[[3-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: 3-(methylthio)propyl-[[3-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: 3-methylsulfanylpropyl-[[3-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: 3-(methylthio)propyl-[3-(trifluoromethyl)benzyl]ammonium Formula: C12H17F3NS+ MolecularWeight: 264.33029

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16F3NS/c1-17-7-3-6-16-9-10-4-2-5-11(8-10)12(13,14)15/h2,4-5,8,16H,3,6-7,9H2,1H3/p+1