4-Fluorophenol → 4-((2,2-Dimethylpropyl){3-[(4-fluorophenyl)oxy]propyl}amino)-2-(trifluoromethyl)benzonitrile
Reaction equation
[CH3:1][C:2]([CH2:3][N:4]([c:5]1[cH:6][c:7]([C:13]([F:14])([F:15])[F:16])[c:8]([C:9]#[N:10])[cH:11][cH:12]1)[CH2:17][CH2:18][CH2:19][OH:20])([CH3:21])[CH3:22].[F:23][c:24]1[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]1>>[CH3:1][C:2]([CH2:3][N:4]([c:5]1[cH:6][c:7]([C:13]([F:14])([F:15])[F:16])[c:8]([C:9]#[N:10])[cH:11][cH:12]1)[CH2:17][CH2:18][CH2:19][O:20][c:27]1[cH:26][cH:25][c:24]([F:23])[cH:29][cH:28]1)([CH3:21])[CH3:22]Participants
3
Sources & evidence
- ORD record
- ord-b651bb0e651643d9ad35c617966ef371
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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