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

Systemtic Name: N-ethyl-N-[[(3R)-1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-methylsulfanyl-propanamide Openeye Name: N-ethyl-N-[[(3R)-1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-methylsulfanyl-propanamide CAS Name: N-ethyl-N-[[(3R)-1-[2-(3-fluorophenyl)ethyl]-3-piperidin-1-iumyl]methyl]-3-(methylthio)propanamide IUPAC Name: N-ethyl-N-[[(3R)-1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-methylsulfanylpropanamide Traditional Name: N-ethyl-N-[[(3R)-1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-3-(methylthio)propionamide Formula: C20H32FN2OS+ MolecularWeight: 367.544283

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CCC[NH+](C1)CCC2=CC(=CC=C2)F)C(=O)CCSC

Isomeric SMILES

CCN(C[C@H]1CCC[NH+](C1)CCC2=CC(=CC=C2)F)C(=O)CCSC

InChI

InChI=1S/C20H31FN2OS/c1-3-23(20(24)10-13-25-2)16-18-7-5-11-22(15-18)12-9-17-6-4-8-19(21)14-17/h4,6,8,14,18H,3,5,7,9-13,15-16H2,1-2H3/p+1/t18-/m0/s1