Toluene → Butyl 1-chloro-4-hydroxy-7-(4-methoxyphenoxy)isoquinoline-3-carboxylate
Reaction equation
[CH2:6]([CH2:7][CH2:8][CH3:9])[O:10][C:11](=[O:12])[c:13]1[n:14][c:15]([OH:33])[c:16]2[cH:17][c:18]([O:24][c:25]3[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]3)[cH:19][cH:20][c:21]2[c:22]1[OH:23].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[P:1]([Cl:2])([Cl:3])([Cl:4])=[O:5]>>[Cl:3][c:15]1[n:14][c:13]([C:11]([O:10][CH2:6][CH2:7][CH2:8][CH3:9])=[O:12])[c:22]([OH:23])[c:21]2[c:16]1[cH:17][c:18]([O:24][c:25]1[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]1)[cH:19][cH:20]2Participants
4
Sources & evidence
- ORD record
- ord-28839d84fef34647b136d4f1263e82e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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