Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H14N4O2.C4H4O4 |
| Molecular Weight | 374.348 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.[O-][N+](=O)C1=CC=C2N=C(C=CC2=C1)N3CCNCC3
InChI
InChIKey=LXOHMGALVZOYRF-BTJKTKAUSA-N
InChI=1S/C13H14N4O2.C4H4O4/c18-17(19)11-2-3-12-10(9-11)1-4-13(15-12)16-7-5-14-6-8-16;5-3(6)1-2-4(7)8/h1-4,9,14H,5-8H2;1-2H,(H,5,6)(H,7,8)/b;2-1-
| Molecular Formula | C13H14N4O2 |
| Molecular Weight | 258.2759 |
| 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 20:56:13 GMT 2025
by
admin
on
Mon Mar 31 20:56:13 GMT 2025
|
| Record UNII |
ORQ6D36T5V
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| Record Status |
Validated (UNII)
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| Record Version |
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