Bromide ion → C25H23F3N4O2
Reaction equation
[Br-:42].[CH2:43]([N+:44]([CH2:45][CH2:46][CH2:47][CH3:48])([CH2:49][CH2:50][CH2:51][CH3:52])[CH2:53][CH2:54][CH2:55][CH3:56])[CH2:57][CH2:58][CH3:59].[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]=[CH:10][c:11]2[o:12][cH:13][c:14]([CH2:16][CH2:17][S:18]([O-:19])(=[O:20])=[O:21])[n:15]2)[cH:7][cH:8]1)([F:22])[F:23].[Na+:41].[OH-:40].[n:24]1([CH2:29][CH2:30][CH2:31][CH2:32][c:33]2[cH:34][cH:35][c:36]([OH:39])[cH:37][cH:38]2)[n:25][n:26][cH:27][cH:28]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]=[CH:10][c:11]2[o:12][cH:13][c:14]([CH2:16][O:39][c:36]3[cH:35][cH:34][c:33]([CH2:32][CH2:31][CH2:30][CH2:29][n:24]4[n:25][n:26][cH:27][cH:28]4)[cH:38][cH:37]3)[n:15]2)[cH:7][cH:8]1)([F:22])[F:23]Participants
8
Sources & evidence
- ORD record
- ord-9b983cd49dfa4206aae74bbd5fa4fc47
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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