Water → 4-Chloro-3-hydroxy-2-(1-methyl-1-phenylethyl)isoindolinone
Reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:20][N:21]([CH3:22])[CH2:23][CH2:24][N:25]([CH3:26])[CH3:27].[CH3:28][CH2:29][CH2:30][CH2:31][CH2:32][CH3:33].[CH:34]([Li:35])([CH2:36][CH3:37])[CH3:38].[Cl:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][C:8]([CH3:9])([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[CH3:16])[cH:17][cH:18][cH:19]1.[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH2:49]>>[Cl:1][c:2]1[c:3]2[c:4]([cH:17][cH:18][cH:19]1)[C:5](=[O:6])[N:7]([C:8]([CH3:9])([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[CH3:16])[CH:40]2[OH:39]Participants
8
Sources & evidence
- ORD record
- ord-93d88da615bd4c61b9afd1b4c58d1891
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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