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
Wed Apr 02 08:03:52 GMT 2025
by
admin
on
Wed Apr 02 08:03:52 GMT 2025
|
| Record UNII |
X9N1XKR2OS
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
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Preferred Name | English | ||
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29756
Created by
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1766
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CHEMBL2105609
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m625
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3567-38-2
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3703
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DTXSID70863200
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| 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 |