Benzene → N-(1-methoxy-2,2,2-trichloroethyl)nicotinamide
Reaction equation
[C:35](=[O:36])([OH:37])[O-:38].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][OH:48].[Cl:20][CH:21]([NH:22][C:23](=[O:24])[c:25]1[cH:26][cH:27][cH:28][n:29][cH:30]1)[C:31]([Cl:32])([Cl:33])[Cl:34].[Na+:39].[OH:1][CH:2]([C:3]([Cl:4])([Cl:5])[Cl:6])[NH:7][C:8]([c:9]1[cH:10][n:11][cH:12][cH:13][cH:14]1)=[O:15].[S:16]([Cl:17])([Cl:18])=[O:19].[cH:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[O:1]([CH:2]([C:3]([Cl:4])([Cl:5])[Cl:6])[NH:7][C:8]([c:9]1[cH:10][n:11][cH:12][cH:13][cH:14]1)=[O:15])[CH3:21]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-ed2ec304c0b149d48ab7406bb1508a8d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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