Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H17BrClN3O3 |
| Molecular Weight | 414.681 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]1CCCN[C@@H]1CC(=O)CN2C=NC3=CC(Br)=C(Cl)C=C3C2=O
InChI
InChIKey=LVASCWIMLIKXLA-CABCVRRESA-N
InChI=1S/C16H17BrClN3O3/c17-11-6-13-10(5-12(11)18)16(24)21(8-20-13)7-9(22)4-14-15(23)2-1-3-19-14/h5-6,8,14-15,19,23H,1-4,7H2/t14-,15+/m1/s1
| Molecular Formula | C16H17BrClN3O3 |
| Molecular Weight | 414.681 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:06:56 UTC 2023
by
admin
on
Sat Dec 16 19:06:56 UTC 2023
|
| Record UNII |
H84E4Y7HC9
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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H84E4Y7HC9
Created by
admin on Sat Dec 16 19:06:57 UTC 2023 , Edited by admin on Sat Dec 16 19:06:57 UTC 2023
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456390
Created by
admin on Sat Dec 16 19:06:57 UTC 2023 , Edited by admin on Sat Dec 16 19:06:57 UTC 2023
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868851-54-1
Created by
admin on Sat Dec 16 19:06:57 UTC 2023 , Edited by admin on Sat Dec 16 19:06:57 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
RACEMATE -> ENANTIOMER |
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