Acetic Acid → 1-acetyl-4-[(3-fluoro-4-methyl-phenyl)methyl]-1,2-dihydro-5-methyl-3H-pyrazol-3-one
Reaction equation
[C:17](=[O:18])([O-:19])[O-:20].[CH3:23][C:24](=[O:25])[O:26][C:27](=[O:28])[CH3:29].[CH3:30][C:31](=[O:32])[OH:33].[CH3:34][N:35]([CH3:36])[CH:37]=[O:38].[F:1][c:2]1[cH:3][c:4]([CH2:9][c:10]2[c:11](=[O:16])[nH:12][nH:13][c:14]2[CH3:15])[cH:5][cH:6][c:7]1[CH3:8].[K+:21].[K+:22].[OH2:39]>>[F:1][c:2]1[cH:3][c:4]([CH2:9][c:10]2[c:11](=[O:16])[nH:12][n:13]([C:24]([CH3:23])=[O:25])[c:14]2[CH3:15])[cH:5][cH:6][c:7]1[CH3:8]Participants
8
Sources & evidence
- ORD record
- ord-3ab38520de264708a7a5a1ac697004fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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