Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C11H18N2O3S.ClH |
| Molecular Weight | 294.798 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CN[C@@H](C)[C@H](O)C1=CC=C(NS(C)(=O)=O)C=C1
InChI
InChIKey=OMGYZLAJZAMSKO-RWHJDYSMSA-N
InChI=1S/C11H18N2O3S.ClH/c1-8(12-2)11(14)9-4-6-10(7-5-9)13-17(3,15)16;/h4-8,11-14H,1-3H3;1H/t8-,11-;/m0./s1
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C11H18N2O3S |
| Molecular Weight | 258.337 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Originator
Sources: https://www.ncbi.nlm.nih.gov/pubmed/6006227
Curator's Comment: reference retrieved from https://link.springer.com/book/10.1007/978-1-4757-2085-3#about
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:12:45 GMT 2025
by
admin
on
Mon Mar 31 19:12:45 GMT 2025
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| Record UNII |
7XTP5J0Y5D
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| Record Status |
Validated (UNII)
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| Record Version |
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C175128
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955-48-6
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NON-SPECIFIC STEREOCHEMISTRY |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |