Details
Stereochemistry | RACEMIC |
Molecular Formula | C12H18N2O4.ClH |
Molecular Weight | 290.743 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC(C(O)CNC(=O)CN)=C(OC)C=C1
InChI
InChIKey=MGCQZNBCJBRZDT-UHFFFAOYSA-N
InChI=1S/C12H18N2O4.ClH/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13;/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16);1H
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 | C12H18N2O4 |
Molecular Weight | 254.2823 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:31:05 UTC 2023
by
admin
on
Fri Dec 15 15:31:05 UTC 2023
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Record UNII |
59JV96YTXV
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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 |
C29709
Created by
admin on Fri Dec 15 15:31:05 UTC 2023 , Edited by admin on Fri Dec 15 15:31:05 UTC 2023
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FDA ORPHAN DRUG |
7585
Created by
admin on Fri Dec 15 15:31:05 UTC 2023 , Edited by admin on Fri Dec 15 15:31:05 UTC 2023
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Code System | Code | Type | Description | ||
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DBSALT000250
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31847
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U-33
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SUB03291MIG
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100000090278
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758429
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18340
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DTXSID1047493
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3092-17-9
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CHEMBL1201212
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m7533
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admin on Fri Dec 15 15:31:05 UTC 2023 , Edited by admin on Fri Dec 15 15:31:05 UTC 2023
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993491
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admin on Fri Dec 15 15:31:05 UTC 2023 , Edited by admin on Fri Dec 15 15:31:05 UTC 2023
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43218-56-0
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59JV96YTXV
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1443704
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C47620
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59JV96YTXV
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256-148-3
Created by
admin on Fri Dec 15 15:31:05 UTC 2023 , Edited by admin on Fri Dec 15 15:31:05 UTC 2023
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Related Record | Type | Details | ||
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ENANTIOMER -> RACEMATE | |||
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PARENT -> SALT/SOLVATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |