Bromide ion → 2-(4-Chloro-3-trifluoromethyl-phenyl)-1,3,4,5-tetrahydro-azepino[5,4,3-cd]indol-6-one
Reaction equation
[Br-:21].[Cl:22][c:23]1[c:24]([C:32]([F:33])([F:34])[F:35])[cH:25][c:26]([B:29]([OH:30])[OH:31])[cH:27][cH:28]1.[c:1]1(-[c:7]2[nH:8][c:9]3[cH:10][cH:11][cH:12][c:13]4[c:14]3[c:15]2[CH2:16][CH2:17][NH:18][C:19]4=[O:20])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:7]1(-[c:26]2[cH:25][c:24]([C:32]([F:33])([F:34])[F:35])[c:23]([Cl:22])[cH:28][cH:27]2)[nH:8][c:9]2[cH:10][cH:11][cH:12][c:13]3[c:14]2[c:15]1[CH2:16][CH2:17][NH:18][C:19]3=[O:20]Participants
4
Sources & evidence
- ORD record
- ord-55122da9acbb4b2ba4b2265f5b16ff51
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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