Details
Stereochemistry | ACHIRAL |
Molecular Formula | C21H19BrN8O6 |
Molecular Weight | 559.33 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(C=C(NC(C)=O)C(=C1)\N=N\C2=C(C=C(C=C2Br)[N+]([O-])=O)[N+]([O-])=O)N(CCC#N)CCC#N
InChI
InChIKey=IQWWXXQLHSFCJP-CYYJNZCTSA-N
InChI=1S/C21H19BrN8O6/c1-13(31)25-16-11-18(28(7-3-5-23)8-4-6-24)20(36-2)12-17(16)26-27-21-15(22)9-14(29(32)33)10-19(21)30(34)35/h9-12H,3-4,7-8H2,1-2H3,(H,25,31)/b27-26+
Molecular Formula | C21H19BrN8O6 |
Molecular Weight | 559.33 |
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
Sat Dec 16 11:59:09 GMT 2023
by
admin
on
Sat Dec 16 11:59:09 GMT 2023
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Record UNII |
X995QN8GH2
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Record Status |
Validated (UNII)
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Record Version |
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