Water → 2-(3-Fluoro-phenoxy)-N-[4-(1-hydroxy-1-methyl-ethyl)-benzyl]-nicotinamide
Reaction equation
[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[F:1][c:2]1[cH:3][c:4]([O:5][c:6]2[c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12][cH:13][n:14]2)[cH:15][cH:16][cH:17]1.[NH2:18][CH2:19][c:20]1[cH:21][cH:22][c:23]([C:26]([CH3:27])([CH3:28])[OH:29])[cH:24][cH:25]1.[OH2:30].[OH2:46].[OH:31][n:32]1[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[F:1][c:2]1[cH:3][c:4]([O:5][c:6]2[c:7]([C:8](=[O:10])[NH:18][CH2:19][c:20]3[cH:21][cH:22][c:23]([C:26]([CH3:27])([CH3:28])[OH:29])[cH:24][cH:25]3)[cH:11][cH:12][cH:13][n:14]2)[cH:15][cH:16][cH:17]1Participants
6
Sources & evidence
- ORD record
- ord-3e7481cd80aa40fc8fd27aa5dba2e5e6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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