1-Butanol → 2-[3-[4-[Bis(4-fluorophenyl)methyl]-1-piperidinyl]propoxy]benzonitrile
Reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH2:43]([OH:44])[CH2:45][CH2:46][CH3:47].[CH2:48]([O:49][CH2:50][CH3:51])[CH3:52].[Cl:22][CH2:23][CH2:24][CH2:25][O:26][c:27]1[c:28]([C:29]#[N:30])[cH:31][cH:32][cH:33][cH:34]1.[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:6][cH:7]1.[I-:42].[K+:39].[K+:40].[K+:41]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]2[CH2:10][CH2:11][N:12]([CH2:23][CH2:24][CH2:25][O:26][c:27]3[c:28]([C:29]#[N:30])[cH:31][cH:32][cH:33][cH:34]3)[CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:6][cH:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-00009ed6a6084dcd88ab6feadd174585
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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