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

Systemtic Name: 3-oxidanylpropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Openeye Name: 3-hydroxypropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]ammonium CAS Name: 3-hydroxypropyl-[[4-(trifluoromethylthio)phenyl]methyl]ammonium IUPAC Name: 3-hydroxypropyl-[[4-(trifluoromethylsulfanyl)phenyl]methyl]azanium Traditional Name: 3-hydroxypropyl-[4-(trifluoromethylthio)benzyl]ammonium Formula: C11H15F3NOS+ MolecularWeight: 266.30311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]CCCO)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C[NH2+]CCCO)SC(F)(F)F

InChI

InChI=1S/C11H14F3NOS/c12-11(13,14)17-10-4-2-9(3-5-10)8-15-6-1-7-16/h2-5,15-16H,1,6-8H2/p+1