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Eszopiclone N-Oxide

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For Research Use Only | Not For Clinical Use
CATAPS151851706
CAS151851-70-6
Structure
IUPAC Name[(7S)-6-(5-chloropyridin-2-yl)-5-oxo-7H-pyrrolo[3,4-b]pyrazin-7-yl] 4-methyl-4-oxidopiperazin-4-ium-1-carboxylate
Molecular Weight404.81
Molecular FormulaC17H17ClN6O4
Canonical SMILESC[N+]1([O-])CCN(CC1)C(=O)O[C@@H]2N(C(=O)c3nccnc23)c4ccc(Cl)cn4
InChIInChI=1S/C17H17ClN6O4/c1-24(27)8-6-22(7-9-24)17(26)28-16-14-13(19-4-5-20-14)15(25)23(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3/t16-/m0/s1
Accurate Mass404.1
FormatNeat
SubcategoryAdditional pharmaceutical toxicology reference materials, Additional TDM reference materials
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