Details
Stereochemistry | RACEMIC |
Molecular Formula | C17H19F2N3O3.ClH |
Molecular Weight | 387.809 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCN1C=C(C(O)=O)C(=O)C2=CC(F)=C(N3CCNC(C)C3)C(F)=C12
InChI
InChIKey=KXEBLAPZMOQCKO-UHFFFAOYSA-N
InChI=1S/C17H19F2N3O3.ClH/c1-3-21-8-11(17(24)25)16(23)10-6-12(18)15(13(19)14(10)21)22-5-4-20-9(2)7-22;/h6,8-9,20H,3-5,7H2,1-2H3,(H,24,25);1H
Molecular Formula | C17H19F2N3O3 |
Molecular Weight | 351.3479 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
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
Fri Dec 15 15:55:17 UTC 2023
by
admin
on
Fri Dec 15 15:55:17 UTC 2023
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Record UNII |
9VC7S3ZXXB
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C795
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admin on Fri Dec 15 15:55:17 UTC 2023 , Edited by admin on Fri Dec 15 15:55:17 UTC 2023
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DBSALT000795
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m6889
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AA-14
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DTXSID2045527
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98079-52-8
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758168
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6518
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SUB02967MIG
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CHEMBL561
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68624
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100000091857
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235762
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C47587
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9VC7S3ZXXB
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9VC7S3ZXXB
Created by
admin on Fri Dec 15 15:55:17 UTC 2023 , Edited by admin on Fri Dec 15 15:55:17 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |