Hydrochloric Acid → 7-(4-Butoxyphenyl)-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[cH:13][cH:14][c:15]3[c:16]([cH:28]2)[CH:17]=[C:18]([C:24](=[O:25])[O:26][CH3:27])[CH2:19][CH2:20][S:21]3(=[O:22])=[O:23])[cH:10][cH:11]1.[CH3:30][O:31][CH2:32][CH2:33][O:34][CH3:35].[ClH:29]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[cH:13][cH:14][c:15]3[c:16]([cH:28]2)[CH:17]=[C:18]([C:24](=[O:25])[OH:26])[CH2:19][CH2:20][S:21]3(=[O:22])=[O:23])[cH:10][cH:11]1Participants
4
Sources & evidence
- ORD record
- ord-242860c17d2b484180e3c3316c00808a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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