Carbon Tetrachloride → 1-Bromo-8-(4-fluoro-phenoxy)-4-hydroxy-isoquinoline-3-carboxylic acid methyl ester
Reaction equation
[Br:24][N:25]1[C:26](=[O:27])[CH2:28][CH2:29][C:30]1=[O:31].[C:32]([O:33][O:34][C:35](=[O:36])[c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)(=[O:43])[c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[C:50]([Cl:51])([Cl:52])([Cl:53])[Cl:54].[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][cH:7][c:8]2[c:9]([O:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:10][cH:11][cH:12][c:13]2[c:14]1[OH:15]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][c:7]([Br:24])[c:8]2[c:9]([O:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:10][cH:11][cH:12][c:13]2[c:14]1[OH:15]Participants
5
Sources & evidence
- ORD record
- ord-4d7076073c264231985919e462036632
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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