Acetic Acid → 3-Chloro-4,5,6,7-tetrahydro-1,2-benzisothiazol-4-one
Reaction equation
[CH3:32][C:33](=[O:34])[OH:35].[Cl:12][c:13]1[n:14][s:15][c:16]2[c:17]1[CH2:18][CH2:19][CH2:20][CH2:21]2.[Na+:1].[Na+:27].[Na+:2].[O-:3][Cr:4]([O:5][Cr:6](=[O:7])(=[O:8])[O-:9])(=[O:10])=[O:11].[OH:28][C:29](=[O:30])[O-:31].[S:22]([OH:23])(=[O:24])(=[O:25])[OH:26]>>[Cl:12][c:13]1[n:14][s:15][c:16]2[c:17]1[C:18](=[O:23])[CH2:19][CH2:20][CH2:21]2Participants
7
Sources & evidence
- ORD record
- ord-9e15303443964b0f931429262883381a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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