Bromide ion → Tert-butyl 4-(3-cyclohexylprop-1-enyl)-2-(4-fluoroanilino)benzoate
Reaction equation
[Br-:38].[Br:1][c:2]1[cH:3][c:4]([NH:15][c:16]2[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]2)[c:5]([C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[cH:13][cH:14]1.[C:32](=[O:33])([O-:34])[O-:35].[CH2:23]([CH:24]=[CH2:25])[CH:26]1[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]1.[CH3:39][CH2:40][CH2:41][CH2:42][N+:43]([CH2:44][CH2:45][CH2:46][CH3:47])([CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH2:54][CH3:55].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cs+:36].[Cs+:37]>>[c:2]1([CH:25]=[CH:24][CH2:23][CH:26]2[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]2)[cH:3][c:4]([NH:15][c:16]2[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]2)[c:5]([C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[cH:13][cH:14]1Participants
8
Sources & evidence
- ORD record
- ord-77fbc91a63b249b8a82022cd0d920c2b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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