TIOTROPIUM BROMIDE
(9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 2-hydroxy-2,2-dithiophen-2-ylacetate bromide
Also Known As: TIOTROPIUM BROMIDE|Spiriva|Tiotropium|Spiriva Handihaler|Tiotropium (Bromide)|AC1Q1RHA|Tiotropium bromide hydrate|AC1L1U0B|Tiotropium bromide monohydrate|BA 679BR|BA679 BR|Tiotropium bromide [USAN:INN]|BA 679 BR|BA-679 BR|679 BR, BA|SR-01000942216-1|(9,9-Dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 2-hydroxy-2,2-dithiophen-2-ylacetate;bromide|7-(2-Hydroxy-2,2-di(thiophen-2-yl)acetoxy)-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-9-ium bromide|(1|A,2|A,4|A,5|A,7|A)-7-[(2-Hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane Bromide|(9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 2-hydroxy-2,2-bis(2-thienyl)acetate;bromide|[(1R,2R,4S,5S)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.0^{2,4]nonan-7-yl] 2-hydroxy-2,2-dithiophen-2-ylacetate;bromide|3-Oxa-9-azoniatricyclo(3,3.1.0(2,4))nonane, 7-((hydroxydi-2-thienylacetyl)oxy)-9,9-dimethyl-, bromide, (1alpha,2beta,4beta,5alpha,7beta)-|3-oxa-9-azoniatricyclo(3,3.1.0(2,4))nonane,7-((hydroxydi-2-thienylacetyl)oxy)9,9-dimethyl-,bromide,(1alpha,2beta,4beta,5alpha,7beta)-|7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.0(2,4))nonane bromide|7-[(Hydroxy-2-thienyl-3-thienylacetyl)oxy]-9,9-dimethyl-3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane Bromide|7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide|rel-(1R,2R,4S,5S,7s)-7-(2-Hydroxy-2,2-di(thiophen-2-yl)acetoxy)-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-9-ium bromide
| Molecular Formula | C19H22BrNO4S2 |
|---|---|
| Molecular Weight | 471.01736 g/mol |
| LogP | -0.65 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 471.01736 |
| Heavy Atoms | 27 |
| Complexity | 768.6 |
Chemical Identifiers
| CAS Number | 136310-93-5 |
|---|---|
| SMILES | C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(C4=CC=CS4)(C5=CC=CS5)O)C.[Br-] |
Product Overview
TIOTROPIUM BROMIDE (CAS 136310-93-5), with molecular formula C19H22BrNO4S2 and molecular weight 471.01736 g/mol. IUPAC: (9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 2-hydroxy-2,2-dithiophen-2-ylacetate bromide.
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