Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C17H18ClN3O.C4H4O4 |
| Molecular Weight | 431.869 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN(C)CCN1C2=CC=C(Cl)C=C2NC3=CC=CC=C3C1=O
InChI
InChIKey=WSYFVTFMLCQUCE-BTJKTKAUSA-N
InChI=1S/C17H18ClN3O.C4H4O4/c1-20(2)9-10-21-16-8-7-12(18)11-15(16)19-14-6-4-3-5-13(14)17(21)22;5-3(6)1-2-4(7)8/h3-8,11,19H,9-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C17H18ClN3O |
| Molecular Weight | 315.797 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 17:57:16 GMT 2025
by
admin
on
Mon Mar 31 17:57:16 GMT 2025
|
| Record UNII |
9QO8QW61XL
|
| Record Status |
Validated (UNII)
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| Record Version |
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Preferred Name | English |
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9QO8QW61XL
Created by
admin on Mon Mar 31 17:57:16 GMT 2025 , Edited by admin on Mon Mar 31 17:57:16 GMT 2025
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23294-07-7
Created by
admin on Mon Mar 31 17:57:16 GMT 2025 , Edited by admin on Mon Mar 31 17:57:16 GMT 2025
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133082994
Created by
admin on Mon Mar 31 17:57:16 GMT 2025 , Edited by admin on Mon Mar 31 17:57:16 GMT 2025
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
