Toluene → 1-(1,3,3a,4,7,7a-Hexahydroisoindol-2-yl)-2-(3,4-dichlorophenyl)ethanone
Reaction equation
[C:13]([n:14]1[cH:15][cH:16][n:17][cH:18]1)([n:19]1[cH:20][cH:21][n:22][cH:23]1)=[O:24].[CH2:25]1[NH:26][CH2:27][CH:28]2[CH2:29][CH:30]=[CH:31][CH2:32][CH:33]12.[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cl:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:11])[OH:12])[cH:5][cH:6][c:7]1[Cl:8]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:9][C:10](=[O:12])[N:26]2[CH2:25][CH:33]3[CH:28]([CH2:27]2)[CH2:29][CH:30]=[CH:31][CH2:32]3)[cH:5][cH:6][c:7]1[Cl:8]Participants
6
Sources & evidence
- ORD record
- ord-732e79f4783c4e8ea0bd667d33df53f8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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