Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.2319 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)C(=CC1=CC(=CC=C1)C#N)C(C)=O
InChI
InChIKey=WXGVASWIUBFCHW-UHFFFAOYSA-N
InChI=1S/C13H11NO2/c1-9(15)13(10(2)16)7-11-4-3-5-12(6-11)8-14/h3-7H,1-2H3
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.2319 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:33:25 UTC 2023
by
admin
on
Fri Dec 15 15:33:25 UTC 2023
|
| Record UNII |
GLI733V999
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Code | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C2080
Created by
admin on Fri Dec 15 15:33:25 UTC 2023 , Edited by admin on Fri Dec 15 15:33:25 UTC 2023
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137109-71-8
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7217
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SUB06090MIG
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DTXSID50160082
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100000088405
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179347
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GLI733V999
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C73033
Created by
admin on Fri Dec 15 15:33:25 UTC 2023 , Edited by admin on Fri Dec 15 15:33:25 UTC 2023
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CHEMBL2104636
Created by
admin on Fri Dec 15 15:33:25 UTC 2023 , Edited by admin on Fri Dec 15 15:33:25 UTC 2023
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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