Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H17N3O.C7H6O3 |
| Molecular Weight | 369.4143 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C1=C(O)C=CC=C1.CN(C)C2=C(C)N(C)N(C2=O)C3=CC=CC=C3
InChI
InChIKey=OENATKSIWPUNNX-UHFFFAOYSA-N
InChI=1S/C13H17N3O.C7H6O3/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11;8-6-4-2-1-3-5(6)7(9)10/h5-9H,1-4H3;1-4,8H,(H,9,10)
| Molecular Formula | C7H6O3 |
| Molecular Weight | 138.1207 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C13H17N3O |
| Molecular Weight | 231.2936 |
| 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
Mon Mar 31 21:18:29 GMT 2025
by
admin
on
Mon Mar 31 21:18:29 GMT 2025
|
| Record UNII |
S81P8R6VYO
|
| Record Status |
Validated (UNII)
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| Record Version |
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603-57-6
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3083638
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210-049-1
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admin on Mon Mar 31 21:18:29 GMT 2025 , Edited by admin on Mon Mar 31 21:18:29 GMT 2025
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DTXSID40975708
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admin on Mon Mar 31 21:18:29 GMT 2025 , Edited by admin on Mon Mar 31 21:18:29 GMT 2025
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S81P8R6VYO
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admin on Mon Mar 31 21:18:29 GMT 2025 , Edited by admin on Mon Mar 31 21:18:29 GMT 2025
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m1740
Created by
admin on Mon Mar 31 21:18:29 GMT 2025 , Edited by admin on Mon Mar 31 21:18:29 GMT 2025
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PRIMARY | Merck Index |
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