Sodium ion → 3-[4-(2-n-Butoxy-3,5-di-iso-propylphenyl)-5-fluorobenzo[b]thien-2-yl]-but-2-enoic acid ethyl ester
Reaction equation
[C:17]([CH3:18])(=[O:19])[c:20]1[cH:21][c:22]2[c:23]([s:24]1)[cH:25][cH:26][c:27]([F:46])[c:28]2-[c:29]1[c:30]([O:41][CH2:42][CH2:43][CH2:44][CH3:45])[c:31]([CH:38]([CH3:39])[CH3:40])[cH:32][c:33]([CH:35]([CH3:36])[CH3:37])[cH:34]1.[CH3:3][CH2:4][O:5][C:6](=[O:7])[CH2:8][P:9]([O:10][CH2:11][CH3:12])([O:13][CH2:14][CH3:15])=[O:16].[H-:2].[Na+:1].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:47]>>[CH3:3][CH2:4][O:5][C:6](=[O:7])[CH:8]=[C:17]([CH3:18])[c:20]1[cH:21][c:22]2[c:23]([s:24]1)[cH:25][cH:26][c:27]([F:46])[c:28]2-[c:29]1[c:30]([O:41][CH2:42][CH2:43][CH2:44][CH3:45])[c:31]([CH:38]([CH3:39])[CH3:40])[cH:32][c:33]([CH:35]([CH3:36])[CH3:37])[cH:34]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-712ca99911094547b7518c53f30a8402
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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