Ethanol → 2-(4-Amino-3-trifluoromethyl-phenyl)-4-methyl-pentanoic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12]([C:19]([F:20])([F:21])[F:22])[c:13]([N+:16]([O-:17])=[O:18])[cH:14][cH:15]1)=[O:23].[CH3:28][CH2:29][OH:30].[OH2:27].[Sn:24]([Cl:25])[Cl:26]>>[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12]([C:19]([F:20])([F:21])[F:22])[c:13]([NH2:16])[cH:14][cH:15]1)=[O:23]Participants
5
Sources & evidence
- ORD record
- ord-d8e59e8d26bc4966a1cacb61d3790d91
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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