Benzene → HCID 54084630, compound
Reaction equation
[Br:23][N:24]1[C:25](=[O:26])[CH2:27][CH2:28][C:29]1=[O:30].[C:31]([O:32][O:33][C:34](=[O:35])[c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)(=[O:42])[c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH3:1][O:2][C:3]([C:4](=[N:5][O:6][CH3:7])[c:8]1[c:9]([O:14][c:15]2[cH:16][c:17]([CH3:21])[cH:18][cH:19][cH:20]2)[cH:10][cH:11][cH:12][cH:13]1)=[O:22].[cH:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[CH3:1][O:2][C:3]([C:4](=[N:5][O:6][CH3:7])[c:8]1[c:9]([O:14][c:15]2[cH:16][c:17]([CH2:21][Br:23])[cH:18][cH:19][cH:20]2)[cH:10][cH:11][cH:12][cH:13]1)=[O:22]Participants
5
Sources & evidence
- ORD record
- ord-d14ce91d5a19424fad86d20692e846f2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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