Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.2157 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNCCC1=CC2=C(OCO2)C=C1
InChI
InChIKey=OPJOMVMFYOUDPK-UHFFFAOYSA-N
InChI=1S/C10H13NO2/c1-11-5-4-8-2-3-9-10(6-8)13-7-12-9/h2-3,6,11H,4-5,7H2,1H3
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.2157 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
DescriptionSources: https://www.ncbi.nlm.nih.gov/pubmed/4896168
Sources: https://www.ncbi.nlm.nih.gov/pubmed/4896168
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:05:23 GMT 2025
by
admin
on
Mon Mar 31 18:05:23 GMT 2025
|
| Record UNII |
6FJ4B5B368
|
| Record Status |
Validated (UNII)
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| 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 |
C66917
Created by
admin on Mon Mar 31 18:05:23 GMT 2025 , Edited by admin on Mon Mar 31 18:05:23 GMT 2025
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| Code System | Code | Type | Description | ||
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100000083983
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688
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SUB08047MIG
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1378
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6FJ4B5B368
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DTXSID90196385
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10776
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C65856
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451-77-4
Created by
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CHEMBL2104353
Created by
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Homarylamine
Created by
admin on Mon Mar 31 18:05:23 GMT 2025 , Edited by admin on Mon Mar 31 18:05:23 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |