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

Systemtic Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-methylsulfanyl-ethanamide Openeye Name: N-methyl-2-methylsulfanyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]acetamide CAS Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-2-(methylthio)acetamide IUPAC Name: N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-2-methylsulfanylacetamide Traditional Name: N-methyl-2-(methylthio)-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]acetamide Formula: C19H31N2OS+ MolecularWeight: 335.52724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCCC(C2)CN(C)C(=O)CSC

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC[C@@H](C2)CN(C)C(=O)CSC

InChI

InChI=1S/C19H30N2OS/c1-16-7-4-5-9-18(16)10-12-21-11-6-8-17(14-21)13-20(2)19(22)15-23-3/h4-5,7,9,17H,6,8,10-15H2,1-3H3/p+1/t17-/m1/s1