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N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-methylsulfanyl-propanamide

N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-methylsulfanyl-propanamide

Systemtic Name:N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-methylsulfanyl-propanamide
Openeye Name:N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-methylsulfanyl-propanamide
CAS Name:N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-3-(methylthio)propanamide
IUPAC Name:N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3-methylsulfanylpropanamide
Traditional Name:N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-3-(methylthio)propionamide
Formula: C16H24FN2OS+
MolecularWeight: 311.437963
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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NC1CCC[NH+](C1)CC2=CC=CC=C2F


Isomeric SMILES

CSCCC(=O)N[C@H]1CCC[NH+](C1)CC2=CC=CC=C2F


InChI

InChI=1S/C16H23FN2OS/c1-21-10-8-16(20)18-14-6-4-9-19(12-14)11-13-5-2-3-7-15(13)17/h2-3,5,7,14H,4,6,8-12H2,1H3,(H,18,20)/p+1/t14-/m0/s1


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