Acetone → 4-(4-Hydroxy-phenylsulfanyl)-3-nitro-benzoic acid methyl ester
Reaction equation
[C:23](=[O:24])([O-:25])[O-:26].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([N+:11](=[O:12])[O-:13])[c:7]([Cl:10])[cH:8][cH:9]1)=[O:14].[CH3:29][C:30](=[O:31])[CH3:32].[Cs+:27].[Cs+:28].[SH:15][c:16]1[cH:17][cH:18][c:19]([OH:22])[cH:20][cH:21]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([N+:11](=[O:12])[O-:13])[c:7]([S:15][c:16]2[cH:17][cH:18][c:19]([OH:22])[cH:20][cH:21]2)[cH:8][cH:9]1)=[O:14]Participants
6
Sources & evidence
- ORD record
- ord-54cce32c46c749fbaebbdaf41ebee204
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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