[(3S)-3-[(4-fluorophenyl)methyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-3-[(4-fluorophenyl)methyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-3-[(4-fluorophenyl)methyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-3-[(4-fluorophenyl)methyl]-1-[3-(methylthio)propyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-3-[(4-fluorophenyl)methyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-3-(4-fluorobenzyl)-1-[3-(methylthio)propyl]piperidin-1-ium-3-yl]methanol Formula: C17H27FNOS+ MolecularWeight: 312.465783

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH+]1CCCC(C1)(CC2=CC=C(C=C2)F)CO

Isomeric SMILES

CSCCC[NH+]1CCC[C@@](C1)(CC2=CC=C(C=C2)F)CO

InChI

InChI=1S/C17H26FNOS/c1-21-11-3-10-19-9-2-8-17(13-19,14-20)12-15-4-6-16(18)7-5-15/h4-7,20H,2-3,8-14H2,1H3/p+1/t17-/m0/s1