Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H17ClFN3O3.ClH |
| Molecular Weight | 402.248 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.N[C@@H]1CCN(C1)C2=C(Cl)C3=C(C=C2F)C(=O)C(=CN3C4CC4)C(O)=O
InChI
InChIKey=BMACYHMTJHBPOX-DDWIOCJRSA-N
InChI=1S/C17H17ClFN3O3.ClH/c18-13-14-10(5-12(19)15(13)21-4-3-8(20)6-21)16(23)11(17(24)25)7-22(14)9-1-2-9;/h5,7-9H,1-4,6,20H2,(H,24,25);1H/t8-;/m1./s1
| Molecular Formula | C17H17ClFN3O3 |
| Molecular Weight | 365.787 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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
Mon Mar 31 18:39:44 GMT 2025
by
admin
on
Mon Mar 31 18:39:44 GMT 2025
|
| Record UNII |
WE78GF5ACB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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WE78GF5ACB
Created by
admin on Mon Mar 31 18:39:44 GMT 2025 , Edited by admin on Mon Mar 31 18:39:44 GMT 2025
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PRIMARY | |||
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186802-93-7
Created by
admin on Mon Mar 31 18:39:44 GMT 2025 , Edited by admin on Mon Mar 31 18:39:44 GMT 2025
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69492572
Created by
admin on Mon Mar 31 18:39:44 GMT 2025 , Edited by admin on Mon Mar 31 18:39:44 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |