Toluene → 3-Chloro-6-(1-ethoxy-vinyl)-isoquinoline
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([Cl:12])[n:7][cH:8][c:9]2[cH:10][cH:11]1.[CH2:13]([Sn:14]([CH2:15][CH2:16][CH2:17][CH3:23])([C:18](=[CH2:19])[O:20][CH2:21][CH3:22])[CH2:24][CH2:25][CH2:26][CH3:27])[CH2:28][CH2:29][CH3:30].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Pd:38]([Cl:39])[Cl:40].[c:41]1([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:55][cH:56][cH:57][cH:58][cH:59]1.[c:60]1([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[cH:74][cH:75][cH:76][cH:77][cH:78]1>>[c:2]1([C:18](=[CH2:19])[O:20][CH2:21][CH3:22])[cH:3][c:4]2[cH:5][c:6]([Cl:12])[n:7][cH:8][c:9]2[cH:10][cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-f764ac7ee3404b0c84c7cfe8dd8d2429
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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