Sodium ion → 5-Bromo-2-(3-(2-chloro-3,6-difluorophenyl)isoxazol-5-ylmethoxy)pyridine
Reaction equation
[Br:1][c:2]1[n:3][cH:4][c:5]([Br:8])[cH:6][cH:7]1.[CH3:25][C:26]([CH3:27])([O-:28])[CH3:29].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:9][c:10]1[c:11](-[c:18]2[n:19][o:20][c:21]([CH2:23][OH:24])[cH:22]2)[c:12]([F:17])[cH:13][cH:14][c:15]1[F:16].[Na+:30].[O:40]=[C:41]([CH:42]=[CH:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[O:58]=[C:59]([CH:60]=[CH:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)[CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[O:76]=[C:77]([CH:78]=[CH:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1)[CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[Pd:38].[Pd:39]>>[c:2]1([O:24][CH2:23][c:21]2[o:20][n:19][c:18](-[c:11]3[c:10]([Cl:9])[c:15]([F:16])[cH:14][cH:13][c:12]3[F:17])[cH:22]2)[n:3][cH:4][c:5]([Br:8])[cH:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-388b75800c4448348b1d63ecbc4a9b4f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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