Sodium ion → 1-[3-(4-Fluoro-2-nitrophenoxy)propyl]-1,3,3-trimethylurea
Reaction equation
[CH3:28][I:29].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[F:8][c:9]1[cH:10][c:11]([N+:25](=[O:26])[O-:27])[c:12]([O:13][CH2:14][CH2:15][CH2:16][NH:17][C:18]([N:19]([CH3:20])[CH3:21])=[O:22])[cH:23][cH:24]1.[H-:1].[Na+:2].[O:3]=[CH:4][N:5]([CH3:6])[CH3:7].[OH2:36]>>[CH3:4][N:17]([CH2:16][CH2:15][CH2:14][O:13][c:12]1[c:11]([N+:25](=[O:26])[O-:27])[cH:10][c:9]([F:8])[cH:24][cH:23]1)[C:18]([N:19]([CH3:20])[CH3:21])=[O:22]Participants
8
Sources & evidence
- ORD record
- ord-4029f0e225ca4a8aa5faed2626f2c782
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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