Acetic Acid → 8-Oxatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),3,5,10,12-hexaene-5-sulfonyl chloride
Reaction equation
[CH3:23][C:24](=[O:25])[OH:26].[ClH:15].[Cu:27]([Cl:28])[Cl:29].[N:16]([O-:17])=[O:18].[NH2:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([o:7][c:8]3[c:9]2[cH:10][cH:11][cH:12][cH:13]3)[cH:14]1.[Na+:19].[O:20]=[S:21]=[O:22].[OH2:36].[cH:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[c:2]1([S:21]([Cl:15])(=[O:20])=[O:22])[cH:3][cH:4][c:5]2[c:6]([o:7][c:8]3[c:9]2[cH:10][cH:11][cH:12][cH:13]3)[cH:14]1Participants
10
Sources & evidence
- ORD record
- ord-33c0a9f874d84d1fa6f8056b3b31d52d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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