3-methoxypropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium

Systemtic Name: 3-methoxypropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Openeye Name: 3-methoxypropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ammonium CAS Name: 3-methoxypropyl-[[4-(trifluoromethylthio)phenyl]methyl]ammonium IUPAC Name: 3-methoxypropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Traditional Name: 3-methoxypropyl-[4-(trifluoromethylthio)benzyl]ammonium Formula: C12H17F3NOS+ MolecularWeight: 280.32969

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16F3NOS/c1-17-8-2-7-16-9-10-3-5-11(6-4-10)18-12(13,14)15/h3-6,16H,2,7-9H2,1H3/p+1