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(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2-Hydroxy-2,2-dithiophen-2-ylacetate

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For Research Use Only | Not For Clinical Use
CATAPS136310640
CAS136310-64-0
Structure
Synonyms2-Thiopheneacetic acid, alpha-hydroxy-alpha-2-thienyl-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, (1alpha,2beta,4beta,5alpha,7beta)-, N-Demethyl tiotropium, (1alpha,2beta,4beta,5alpha,7beta)-7-[(Hydroxydi(2-thienyl)acetyl)oxy]-9-methyl-3-oxa-9-azatricyclo[3.3.1.0]nonane, Di(2-thienyl)glycolic acid scopine ester, Dithienylglycolic acid scopine ester, Scopine hydroxydi(2-thienyl)acetate, 2-Thiopheneacetic acid, alpha-hydroxy-alpha-2-thienyl-, (1alpha,2beta,4beta,5alpha,7beta)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester, Scopine di(2-thienylglycolate), Tiotropium Bromide Monohydrate Imp B (EP)
IUPAC Name(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2-Hydroxy-2,2-dithiophen-2-ylacetate
Molecular Weight377.48
Molecular FormulaC18H19NO4S2
Canonical SMILESCN1[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)C(O)(c4cccs4)c5cccs5
InChIInChI=1S/C18H19NO4S2/c1-19-11-8-10(9-12(19)16-15(11)23-16)22-17(20)18(21,13-4-2-6-24-13)14-5-3-7-25-14/h2-7,10-12,15-16,21H,8-9H2,1H3/t10-,11-,12+,15-,16+
Accurate Mass377.0755
API FamilyMatrix - API Family Tiotropium Bromide Monohydrate
FormatNeat
Product TypeImpurity
ShippingRoom Temperature
Storage Conditions+5°C
SubcategoryMikromol, Impurity standards
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