Hydrochloric Acid → 7-(4-Trifluoromethylphenyl)-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylic acid
Reaction equation
[CH3:29][O:30][CH2:31][CH2:32][O:33][CH3:34].[ClH:28].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:25]2)[CH:14]=[C:15]([C:21](=[O:22])[O:23][CH3:24])[CH2:16][CH2:17][S:18]3(=[O:19])=[O:20])[cH:7][cH:8]1)([F:26])[F:27]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][c:12]3[c:13]([cH:25]2)[CH:14]=[C:15]([C:21](=[O:22])[OH:23])[CH2:16][CH2:17][S:18]3(=[O:19])=[O:20])[cH:7][cH:8]1)([F:26])[F:27]Participants
4
Sources & evidence
- ORD record
- ord-a33740ce1ddf4ce3b916952a7856e63e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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