Hydrochloric Acid → 7-(4-Morpholinophenyl)-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylic acid
Reaction equation
[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:33][CH2:34][OH:35].[ClH:32].[Na+:31].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10](-[c:13]3[cH:14][cH:15][c:16]4[c:17]([cH:29]3)[CH:18]=[C:19]([C:25](=[O:26])[O:27][CH3:28])[CH2:20][CH2:21][S:22]4(=[O:23])=[O:24])[cH:11][cH:12]2)[CH2:5][CH2:6]1.[OH-:30]>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10](-[c:13]3[cH:14][cH:15][c:16]4[c:17]([cH:29]3)[CH:18]=[C:19]([C:25](=[O:26])[OH:27])[CH2:20][CH2:21][S:22]4(=[O:23])=[O:24])[cH:11][cH:12]2)[CH2:5][CH2:6]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-63df2691fc9343308c13bf26cd898166
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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