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

Systemtic Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-2-methylsulfanyl-ethanamide Openeye Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-2-methylsulfanyl-acetamide CAS Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methyl-2-(methylthio)acetamide IUPAC Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-2-methylsulfanylacetamide Traditional Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-2-(methylthio)acetamide Formula: C19H31N2O2S+ MolecularWeight: 351.52664

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)C(=O)CSC

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O2S/c1-20(19(22)15-24-3)13-17-5-4-11-21(14-17)12-10-16-6-8-18(23-2)9-7-16/h6-9,17H,4-5,10-15H2,1-3H3/p+1/t17-/m1/s1