Chloride → Methyl 2-ethyl-5-nitrobenzoate
Reaction equation
[CH2:17]([CH3:18])[Sn:19]([CH2:20][CH3:21])([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:1][O:2][C:3]([c:4]1[c:5]([Br:13])[cH:6][cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1)=[O:14].[CH3:26][N:27]([CH3:28])[CH:29]=[O:30].[Cl-:16].[Li+:15].[Pd:31]([Cl:32])[Cl:33].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([CH2:17][CH3:18])[cH:6][cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1)=[O:14]Participants
8
Sources & evidence
- ORD record
- ord-54edfb81e0804f6fa13794f820fcc91a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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