Ethanol → 5-Bromo-2-hydroxy-6-(pyrrolidin-1-yl)-benzo[de]isoquinoline-1,3-dione
Reaction equation
[B+3:51].[C:56](=[O:57])([O-:58])[O-:59].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][N:9]1[C:10](=[O:29])[c:11]2[cH:12][cH:13][cH:14][c:15]3[c:16]2[c:17]([cH:20][c:21]([Br:28])[c:22]3[N:23]2[CH2:24][CH2:25][CH2:26][CH2:27]2)[C:18]1=[O:19].[CH2:52]([OH:53])[CH3:54].[F:30][C:31]([F:32])([F:33])[C:34]([O-:35])=[O:36].[F:37][C:38]([F:39])([F:40])[C:41]([O-:42])=[O:43].[F:44][C:45]([F:46])([F:47])[C:48]([O-:49])=[O:50].[F:62][C:63]([F:64])([F:65])[C:66]([OH:67])=[O:68].[Na+:60].[Na+:61].[OH2:55]>>[OH:8][N:9]1[C:10](=[O:29])[c:11]2[cH:12][cH:13][cH:14][c:15]3[c:16]2[c:17]([cH:20][c:21]([Br:28])[c:22]3[N:23]2[CH2:24][CH2:25][CH2:26][CH2:27]2)[C:18]1=[O:19]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-7880f327dca445dba81b8db7c8484e2f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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