Acetic Acid → 2-(4-Hydroxy-3-nitrophenyl)-3-methylbutanoic acid
Reaction equation
[CH3:19][C:20](=[O:21])[OH:22].[CH:1]([CH3:2])([CH3:3])[CH:4]([C:5](=[O:6])[OH:7])[c:8]1[cH:9][cH:10][c:11]([OH:14])[cH:12][cH:13]1.[OH:15][N+:16]([O-:17])=[O:18]>>[CH:1]([CH3:2])([CH3:3])[CH:4]([C:5](=[O:6])[OH:7])[c:8]1[cH:9][c:10]([N+:16](=[O:15])[O-:17])[c:11]([OH:14])[cH:12][cH:13]1Participants
4
Sources & evidence
- ORD record
- ord-dadbdc095cbe4a8e9c160440d5ad1db6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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