Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H18F3N3O3 |
| Molecular Weight | 417.3811 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H]1CN(CCN1)C2=CC3=C(C=C2F)C(=O)C(=CN3C4=CC=C(F)C=C4F)C(O)=O
InChI
InChIKey=QKDHBVNJCZBTMR-NSHDSACASA-N
InChI=1S/C21H18F3N3O3/c1-11-9-26(5-4-25-11)19-8-18-13(7-16(19)24)20(28)14(21(29)30)10-27(18)17-3-2-12(22)6-15(17)23/h2-3,6-8,10-11,25H,4-5,9H2,1H3,(H,29,30)/t11-/m0/s1
| Molecular Formula | C21H18F3N3O3 |
| Molecular Weight | 417.3811 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:03:55 GMT 2025
by
admin
on
Mon Mar 31 21:03:55 GMT 2025
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| Record UNII |
JB78FS8QXB
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| 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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130982-85-3
Created by
admin on Mon Mar 31 21:03:55 GMT 2025 , Edited by admin on Mon Mar 31 21:03:55 GMT 2025
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11690217
Created by
admin on Mon Mar 31 21:03:55 GMT 2025 , Edited by admin on Mon Mar 31 21:03:55 GMT 2025
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JB78FS8QXB
Created by
admin on Mon Mar 31 21:03:55 GMT 2025 , Edited by admin on Mon Mar 31 21:03:55 GMT 2025
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77795
Created by
admin on Mon Mar 31 21:03:55 GMT 2025 , Edited by admin on Mon Mar 31 21:03:55 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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