Details
Stereochemistry | ACHIRAL |
Molecular Formula | C21H20BrN7O6 |
Molecular Weight | 546.331 |
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)CC=C
InChI
InChIKey=WUAQCCUTLFMZFP-OCEACIFDSA-N
InChI=1S/C21H20BrN7O6/c1-4-7-27(8-5-6-23)18-11-16(24-13(2)30)17(12-20(18)35-3)25-26-21-15(22)9-14(28(31)32)10-19(21)29(33)34/h4,9-12H,1,5,7-8H2,2-3H3,(H,24,30)/b26-25+
Molecular Formula | C21H20BrN7O6 |
Molecular Weight | 546.331 |
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 13:01:00 GMT 2023
by
admin
on
Sat Dec 16 13:01:00 GMT 2023
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Record UNII |
M6ZHV265VB
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Record Status |
Validated (UNII)
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Record Version |
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DTXSID3071800
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admin on Sat Dec 16 13:01:00 GMT 2023 , Edited by admin on Sat Dec 16 13:01:00 GMT 2023
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