Hydrochloric Acid → 7-(4-Tert-butylphenyl)-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[cH:12][cH:13][c:14]3[c:15]([cH:27]2)[CH:16]=[C:17]([C:23](=[O:24])[O:25][CH3:26])[CH2:18][CH2:19][S:20]3(=[O:21])=[O:22])[cH:9][cH:10]1.[CH3:29][O:30][CH2:31][CH2:32][O:33][CH3:34].[ClH:28]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[cH:12][cH:13][c:14]3[c:15]([cH:27]2)[CH:16]=[C:17]([C:23](=[O:24])[OH:25])[CH2:18][CH2:19][S:20]3(=[O:21])=[O:22])[cH:9][cH:10]1Participants
4
Sources & evidence
- ORD record
- ord-0888102d1e654d71959d4ebc5ca61628
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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