[(3R)-1-methyl-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(3-methylsulfanylpropyl)azanium

Systemtic Name: [(3R)-1-methyl-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(3-methylsulfanylpropyl)azanium Openeye Name: [(3R)-3-hydroxy-1-methyl-2-oxo-3-piperidyl]methyl-(3-methylsulfanylpropyl)ammonium CAS Name: [(3R)-3-hydroxy-1-methyl-2-oxo-3-piperidinyl]methyl-[3-(methylthio)propyl]ammonium IUPAC Name: [(3R)-3-hydroxy-1-methyl-2-oxopiperidin-3-yl]methyl-(3-methylsulfanylpropyl)azanium Traditional Name: [(3R)-3-hydroxy-2-keto-1-methyl-3-piperidyl]methyl-[3-(methylthio)propyl]ammonium Formula: C11H23N2O2S+ MolecularWeight: 247.37752

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1=O)(C[NH2+]CCCSC)O

Isomeric SMILES

CN1CCC[C@](C1=O)(C[NH2+]CCCSC)O

InChI

InChI=1S/C11H22N2O2S/c1-13-7-3-5-11(15,10(13)14)9-12-6-4-8-16-2/h12,15H,3-9H2,1-2H3/p+1/t11-/m1/s1