1-Butanol → Robenacoxib
Reaction equation
[CH2:28]([CH2:29][CH2:30][CH3:31])[OH:32].[CH3:1][N:2]([C:3]([CH2:4][c:5]1[c:6]([NH:13][c:14]2[c:15]([F:23])[c:16]([F:22])[cH:17][c:18]([F:21])[c:19]2[F:20])[cH:7][cH:8][c:9]([CH2:11][CH3:12])[cH:10]1)=[O:24])[CH3:25].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[ClH:33].[Na+:27].[OH-:26]>>[C:3]([CH2:4][c:5]1[c:6]([NH:13][c:14]2[c:15]([F:23])[c:16]([F:22])[cH:17][c:18]([F:21])[c:19]2[F:20])[cH:7][cH:8][c:9]([CH2:11][CH3:12])[cH:10]1)([OH:24])=[O:32]Participants
7
Sources & evidence
- ORD record
- ord-af1bc2a6c45545a0953fbce9b9769a68
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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