6'-Desmethyl-6'-methylhydroxy Etoricoxib N1'-Oxide
Product Code
TRC-D293035-100MG
CAS Number
Product Format
Neat
Molecular Formula
C18 H15 Cl N2 O4 S
Molecular Weight
390.841
Product Categories
Product Information
Chemical Data
Analyte Name
6'-Desmethyl-6'-methylhydroxy Etoricoxib N1'-Oxide
CAS Number
570394-08-0
Molecular Formula
C18 H15 Cl N2 O4 S
Molecular Weight
390.841
Accurate Mass
390.044
SMILES
CS(=O)(=O)c1ccc(cc1)c2cc(Cl)cnc2c3ccc(CO)[n+]([O-])c3
InChI
InChI=1S/C18H15ClN2O4S/c1-26(24,25)16-6-3-12(4-7-16)17-8-14(19)9-20-18(17)13-2-5-15(11-22)21(23)10-13/h2-10,22H,11H2,1H3
IUPAC
[5-[5-chloro-3-(4-methylsulfonylphenyl)pyridin-2-yl]-1-oxidopyridin-1-ium-2-yl]methanol
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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