Details
Stereochemistry | UNKNOWN |
Molecular Formula | C19H28NO5.Br |
Molecular Weight | 430.333 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Br-].COC1C[C@H]2C[C@@H](C[C@@H]1[N+]2(C)C)OC(=O)C3=CC(OC)=C(OC)C=C3
InChI
InChIKey=WZKNTXBEILGRFG-VJHABYHUSA-M
InChI=1S/C19H28NO5.BrH/c1-20(2)13-9-14(11-15(20)17(10-13)23-4)25-19(21)12-6-7-16(22-3)18(8-12)24-5;/h6-8,13-15,17H,9-11H2,1-5H3;1H/q+1;/p-1/t13-,14+,15+,17?;/m1./s1
Molecular Formula | C19H28NO5 |
Molecular Weight | 350.4293 |
Charge | 1 |
Count |
|
Stereochemistry | MIXED |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | BrH |
Molecular Weight | 80.912 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:03:40 UTC 2023
by
admin
on
Sat Dec 16 05:03:40 UTC 2023
|
Record UNII |
DQU189D11U
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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133082415
Created by
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DQU189D11U
Created by
admin on Sat Dec 16 05:03:41 UTC 2023 , Edited by admin on Sat Dec 16 05:03:41 UTC 2023
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22194-32-7
Created by
admin on Sat Dec 16 05:03:41 UTC 2023 , Edited by admin on Sat Dec 16 05:03:41 UTC 2023
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PRIMARY |