Ethylbenzene → 1-[3-(2-Hydroxy-3,3-dimethylbutyl)-5-methoxy-1-benzofuran-2-yl]-2,2-dimethylpropan-1-one
Reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([c:8]([CH3:17])[c:9]([C:11]([C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[o:10]2)[cH:18]1.[CH3:20][CH:21]([N-:22][CH:23]([CH3:24])[CH3:25])[CH3:26].[CH3:27][CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[CH3:35][C:36]([CH:37]=[O:38])([CH3:39])[CH3:40].[CH3:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH3:52].[Li+:19]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([c:8]([CH2:17][CH:37]([C:36]([CH3:35])([CH3:39])[CH3:40])[OH:38])[c:9]([C:11]([C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[o:10]2)[cH:18]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-0182b0a67daa45a884852947530a60f2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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