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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC[NH+](CC1)CCC2=CC=C(C=C2)Cl)C(=O)CCSC

Isomeric SMILES

CN(CC1CC[NH+](CC1)CCC2=CC=C(C=C2)Cl)C(=O)CCSC

InChI

InChI=1S/C19H29ClN2OS/c1-21(19(23)10-14-24-2)15-17-8-12-22(13-9-17)11-7-16-3-5-18(20)6-4-16/h3-6,17H,7-15H2,1-2H3/p+1