Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H14ClN3O.C4H4O4 |
| Molecular Weight | 415.827 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CNC1=NC2=CC=C(Cl)C=C2C(C3=CC=CC=C3)=[N+]([O-])C1
InChI
InChIKey=KTUFOVCQNKFNID-BTJKTKAUSA-N
InChI=1S/C16H14ClN3O.C4H4O4/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15;5-3(6)1-2-4(7)8/h2-9H,10H2,1H3,(H,18,19);1-2H,(H,5,6)(H,7,8)/b;2-1-
| Molecular Formula | C16H14ClN3O |
| Molecular Weight | 299.755 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 17:53:39 GMT 2025
by
admin
on
Mon Mar 31 17:53:39 GMT 2025
|
| Record UNII |
YR3Y673BZG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Preferred Name | English |
| Code System | Code | Type | Description | ||
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YR3Y673BZG
Created by
admin on Mon Mar 31 17:53:39 GMT 2025 , Edited by admin on Mon Mar 31 17:53:39 GMT 2025
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