Potassium Cation → 7-[4-[4-(Trifluoromethyl)benzoyl]benzyl]-1,3-dimethylxanthine
Reaction equation
[C:14](=[O:15])([O-:16])[O-:17].[CH3:1][n:2]1[c:3]2[n:4][cH:5][nH:6][c:7]2[c:8](=[O:9])[n:10]([CH3:11])[c:12]1=[O:13].[F:20][C:21]([c:22]1[cH:23][cH:24][c:25]([C:26](=[O:27])[c:28]2[cH:29][cH:30][c:31]([CH2:32][Br:33])[cH:34][cH:35]2)[cH:36][cH:37]1)([F:38])[F:39].[K+:18].[K+:19].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[OH2:45]>>[CH3:1][n:2]1[c:3]2[n:4][cH:5][n:6]([CH2:32][c:31]3[cH:30][cH:29][c:28]([C:26]([c:25]4[cH:24][cH:23][c:22]([C:21]([F:20])([F:38])[F:39])[cH:37][cH:36]4)=[O:27])[cH:35][cH:34]3)[c:7]2[c:8](=[O:9])[n:10]([CH3:11])[c:12]1=[O:13]Participants
7
Sources & evidence
- ORD record
- ord-c1dbe6f4cf294184a6cf4e55a2ce1a37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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