Toluene → Methyl 3-{[(2,6-dimethylphenyl)oxy]methyl}-5-(1-methylethyl)-4-isoxazolecarboxylate
Reaction equation
[CH3:1][c:2]1[c:3]([OH:9])[c:4]([CH3:8])[cH:5][cH:6][cH:7]1.[CH3:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1.[O:43]=[C:44]([O:45][CH:46]([CH3:47])[CH3:48])[N:49]=[N:50][C:51]([O:52][CH:53]([CH3:54])[CH3:55])=[O:56].[OH:29][CH2:30][c:31]1[n:32][o:33][c:34]([CH:40]([CH3:41])[CH3:42])[c:35]1[C:36](=[O:37])[O:38][CH3:39].[c:10]1([P:11]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[CH3:1][c:2]1[c:3]([O:9][CH2:30][c:31]2[n:32][o:33][c:34]([CH:40]([CH3:41])[CH3:42])[c:35]2[C:36](=[O:37])[O:38][CH3:39])[c:4]([CH3:8])[cH:5][cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-969d806686ba44289cd8e1b521dd1560
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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