Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H17N3O2 |
Molecular Weight | 235.2823 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C\N=[N+](/[O-])CC1=CC=C(C=C1)C(=O)NC(C)C
InChI
InChIKey=JKKVUULNHHEDHE-SQFISAMPSA-N
InChI=1S/C12H17N3O2/c1-9(2)14-12(16)11-6-4-10(5-7-11)8-15(17)13-3/h4-7,9H,8H2,1-3H3,(H,14,16)/b15-13-
Molecular Formula | C12H17N3O2 |
Molecular Weight | 235.2823 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:53:03 GMT 2023
by
admin
on
Fri Dec 15 17:53:03 GMT 2023
|
Record UNII |
XO438X786I
|
Record Status |
Validated (UNII)
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Record Version |
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-
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XO438X786I
Created by
admin on Fri Dec 15 17:53:03 GMT 2023 , Edited by admin on Fri Dec 15 17:53:03 GMT 2023
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PRIMARY | |||
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66944-55-6
Created by
admin on Fri Dec 15 17:53:03 GMT 2023 , Edited by admin on Fri Dec 15 17:53:03 GMT 2023
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PRIMARY | |||
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13344-51-9
Created by
admin on Fri Dec 15 17:53:03 GMT 2023 , Edited by admin on Fri Dec 15 17:53:03 GMT 2023
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NO STRUCTURE GIVEN | |||
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1089720-07-9
Created by
admin on Fri Dec 15 17:53:03 GMT 2023 , Edited by admin on Fri Dec 15 17:53:03 GMT 2023
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ALTERNATIVE |
Related Record | Type | Details | ||
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PARENT -> METABOLITE LESS ACTIVE |