Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H25ClN2O5.BrH |
Molecular Weight | 489.788 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Br.CCOC(=O)C1=C(COCCN)NC(C)=C([C@H]1C2=C(Cl)C=CC=C2)C(=O)OC
InChI
InChIKey=RVCDRXDQZIUQJA-UNTBIKODSA-N
InChI=1S/C20H25ClN2O5.BrH/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;/h5-8,17,23H,4,9-11,22H2,1-3H3;1H/t17-;/m1./s1
Molecular Formula | C20H25ClN2O5 |
Molecular Weight | 408.876 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
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
Sat Dec 16 10:53:38 GMT 2023
by
admin
on
Sat Dec 16 10:53:38 GMT 2023
|
Record UNII |
WUY9EA043S
|
Record Status |
Validated (UNII)
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Record Version |
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-
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WUY9EA043S
Created by
admin on Sat Dec 16 10:53:38 GMT 2023 , Edited by admin on Sat Dec 16 10:53:38 GMT 2023
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117587602
Created by
admin on Sat Dec 16 10:53:38 GMT 2023 , Edited by admin on Sat Dec 16 10:53:38 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |