Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H22NO3S2.Br |
| Molecular Weight | 456.417 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Br-].C[N+]1(C)[C@H]2C[C@@H](C[C@@H]1C=C2)OC(=O)C(O)(C3=CC=CS3)C4=CC=CS4
InChI
InChIKey=XEHSFNAAROJFIZ-NCLQARKCSA-M
InChI=1S/C19H22NO3S2.BrH/c1-20(2)13-7-8-14(20)12-15(11-13)23-18(21)19(22,16-5-3-9-24-16)17-6-4-10-25-17;/h3-10,13-15,22H,11-12H2,1-2H3;1H/q+1;/p-1/t13-,14+,15+;
Approval Year
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Systematic Name | English | ||
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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UB4346VEA5
Created by
admin on Wed Apr 02 17:27:00 GMT 2025 , Edited by admin on Wed Apr 02 17:27:00 GMT 2025
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PRIMARY | |||
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136310-95-7
Created by
admin on Wed Apr 02 17:27:00 GMT 2025 , Edited by admin on Wed Apr 02 17:27:00 GMT 2025
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PRIMARY |
![Structure of (1R,3s,5S)-3-[2-Hydroxy-2,2-di(thiophen-2-yl)acetoxy]-8,8-dimethyl-8-azabicyclo[3.2.1]oct-6-en-8-ium bromide](/img/567c4dcc-b5a0-42fe-b6b3-8d19c1c48dbd.svg "Structure of (1R,3s,5S)-3-[2-Hydroxy-2,2-di(thiophen-2-yl)acetoxy]-8,8-dimethyl-8-azabicyclo[3.2.1]oct-6-en-8-ium bromide")