Details
Stereochemistry | RACEMIC |
Molecular Formula | C10H9NO2 |
Molecular Weight | 175.184 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
NC(=O)OC(C#C)C1=CC=CC=C1
InChI
InChIKey=MTTYXGPMZKRTCI-UHFFFAOYSA-N
InChI=1S/C10H9NO2/c1-2-9(13-10(11)12)8-6-4-3-5-7-8/h1,3-7,9H,(H2,11,12)
Molecular Formula | C10H9NO2 |
Molecular Weight | 175.184 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Originator
Sources: https://www.ncbi.nlm.nih.gov/pubmed/13229436
Curator's Comment: Archives Internationales de Pharmacodynamie et de Therapie (1954), 99, 245-50.
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:35:37 GMT 2023
by
admin
on
Sat Dec 16 16:35:37 GMT 2023
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Record UNII |
X9N1XKR2OS
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29756
Created by
admin on Sat Dec 16 16:35:38 GMT 2023 , Edited by admin on Sat Dec 16 16:35:38 GMT 2023
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Code System | Code | Type | Description | ||
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1766
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CHEMBL2105609
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19111
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100000084593
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C76095
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admin on Sat Dec 16 16:35:38 GMT 2023 , Edited by admin on Sat Dec 16 16:35:38 GMT 2023
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SUB06627MIG
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admin on Sat Dec 16 16:35:38 GMT 2023 , Edited by admin on Sat Dec 16 16:35:38 GMT 2023
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m625
Created by
admin on Sat Dec 16 16:35:38 GMT 2023 , Edited by admin on Sat Dec 16 16:35:38 GMT 2023
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PRIMARY | Merck Index | ||
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3567-38-2
Created by
admin on Sat Dec 16 16:35:38 GMT 2023 , Edited by admin on Sat Dec 16 16:35:38 GMT 2023
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3703
Created by
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X9N1XKR2OS
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DTXSID70863200
Created by
admin on Sat Dec 16 16:35:38 GMT 2023 , Edited by admin on Sat Dec 16 16:35:38 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |