Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H28NO3.Br |
Molecular Weight | 434.367 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Br-].CC[N+]1(CC)CC[C@H](C1)OC(=O)C(O)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChIKey=GGMMWVHTLAENAS-VEIFNGETSA-M
InChI=1S/C22H28NO3.BrH/c1-3-23(4-2)16-15-20(17-23)26-21(24)22(25,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14,20,25H,3-4,15-17H2,1-2H3;1H/q+1;/p-1/t20-;/m1./s1
Molecular Formula | C22H27NO3 |
Molecular Weight | 353.4547 |
Charge | 0 |
Count |
|
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
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
Fri Dec 15 16:22:18 GMT 2023
by
admin
on
Fri Dec 15 16:22:18 GMT 2023
|
Record UNII |
BF7ARZ6V64
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Code System | Code | Type | Description | ||
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76961773
Created by
admin on Fri Dec 15 16:22:18 GMT 2023 , Edited by admin on Fri Dec 15 16:22:18 GMT 2023
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PRIMARY | |||
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BF7ARZ6V64
Created by
admin on Fri Dec 15 16:22:18 GMT 2023 , Edited by admin on Fri Dec 15 16:22:18 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |