N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-methylsulfanyl-propanamide

Systemtic Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-methylsulfanyl-propanamide Openeye Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-methylsulfanyl-propanamide CAS Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methyl-3-(methylthio)propanamide IUPAC Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-methylsulfanylpropanamide Traditional Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-(methylthio)propionamide Formula: C19H30ClN2OS+ MolecularWeight: 369.9723

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=C(C=C2)Cl)C(=O)CCSC

Isomeric SMILES

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

InChI

InChI=1S/C19H29ClN2OS/c1-21(19(23)10-13-24-2)14-17-4-3-11-22(15-17)12-9-16-5-7-18(20)8-6-16/h5-8,17H,3-4,9-15H2,1-2H3/p+1/t17-/m1/s1