Methanol → 4-(4-methyl-1-(4-(4-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)pent-1-en-2-yl)benzoic acid
Reaction equation
[CH3:1][CH:2]([CH2:3][C:4](=[CH:5][c:6]1[cH:7][cH:8][c:9](-[n:12]2[n:13][cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]2)[cH:10][cH:11]1)[c:21]1[cH:22][cH:23][c:24]([C:25](=[O:26])[O:27][CH3:28])[cH:29][cH:30]1)[CH3:31].[CH3:34][OH:35].[Na+:33].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH-:32]>>[CH3:1][CH:2]([CH2:3][C:4](=[CH:5][c:6]1[cH:7][cH:8][c:9](-[n:12]2[n:13][cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]2)[cH:10][cH:11]1)[c:21]1[cH:22][cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:29][cH:30]1)[CH3:31]Participants
6
Sources & evidence
- ORD record
- ord-9f68c40075c54a0b9d74a71fe8c06b4c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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