Carbon Tetrachloride → Methyl 3-[2-benzyloxy-5-(2-chloroethyl)-4-nitroanilino]-4,4,4-trifluoro-2-butenoate
Reaction equation
[CH2:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[O:32][c:33]1[c:34]([NH:35][C:36](=[CH:37][C:38](=[O:39])[O:40][CH3:41])[C:42]([F:43])([F:44])[F:45])[cH:46][c:47]([CH2:53][CH2:54][OH:55])[c:48]([N+:50](=[O:51])[O-:52])[cH:49]1.[Cl:20][C:21]([Cl:22])([Cl:23])[Cl:24].[Cl:56][CH2:57][Cl:58].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH2:21]([Cl:24])[CH2:53][c:47]1[cH:46][c:34]([NH:35][C:36](=[CH:37][C:38](=[O:39])[O:40][CH3:41])[C:42]([F:43])([F:44])[F:45])[c:33]([O:32][CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:49][c:48]1[N+:50](=[O:51])[O-:52]Participants
5
Sources & evidence
- ORD record
- ord-b003311e7fd545fa98ed0a9a6de04d04
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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