Sodium Ion → 6-Chloro-2-(2,2,2-trifluoro-ethoxy)-nicotinonitrile
Reaction equation
[CH3:30][C:31]#[N:32].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[Cl:1][c:2]1[n:3][c:4]([O:11][CH2:12][C:13]([F:14])([F:15])[F:16])[c:5]([C:6](=[O:7])[NH2:8])[cH:9][cH:10]1.[Na+:29].[OH-:28].[P:23]([Cl:24])([Cl:25])([Cl:26])=[O:27].[cH:17]1[cH:18][cH:19][n:20][cH:21][cH:22]1>>[Cl:1][c:2]1[n:3][c:4]([O:11][CH2:12][C:13]([F:14])([F:15])[F:16])[c:5]([C:6]#[N:8])[cH:9][cH:10]1Participants
8
Sources & evidence
- ORD record
- ord-1138bede8bf4481da7a4890bfb7ea36c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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