Details
Stereochemistry | RACEMIC |
Molecular Formula | C20H17FO3S |
Molecular Weight | 356.411 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[S+]([O-])C1=CC=C(\C=C2/C(C)=C(CC(O)=O)C3=C2C=CC(F)=C3)C=C1
InChI
InChIKey=MLKXDPUZXIRXEP-RQZCQDPDSA-N
InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9+
Molecular Formula | C20H17FO3S |
Molecular Weight | 356.411 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 07:58:19 UTC 2023
by
admin
on
Sat Dec 16 07:58:19 UTC 2023
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Record UNII |
5NVO8803F9
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Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID90860554
Created by
admin on Sat Dec 16 07:58:19 UTC 2023 , Edited by admin on Sat Dec 16 07:58:19 UTC 2023
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5NVO8803F9
Created by
admin on Sat Dec 16 07:58:19 UTC 2023 , Edited by admin on Sat Dec 16 07:58:19 UTC 2023
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258-873-0
Created by
admin on Sat Dec 16 07:58:19 UTC 2023 , Edited by admin on Sat Dec 16 07:58:19 UTC 2023
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53933-60-1
Created by
admin on Sat Dec 16 07:58:19 UTC 2023 , Edited by admin on Sat Dec 16 07:58:19 UTC 2023
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1642019
Created by
admin on Sat Dec 16 07:58:19 UTC 2023 , Edited by admin on Sat Dec 16 07:58:19 UTC 2023
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1548885
Created by
admin on Sat Dec 16 07:58:19 UTC 2023 , Edited by admin on Sat Dec 16 07:58:19 UTC 2023
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Related Record | Type | Details | ||
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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