Acetic Acid → 5-[(2,4-dimethoxy-benzyl)-methyl-amino]-3H-isobenzofuran-1-one
Reaction equation
[C:25]([BH3-:26])#[N:27].[C:29]([OH:30])(=[O:31])[CH3:32].[CH2:23]=[O:24].[CH3:1][O:2][c:3]1[c:4]([CH2:5][NH:6][c:7]2[cH:8][c:9]3[c:13]([cH:14][cH:15]2)[C:12](=[O:16])[O:11][CH2:10]3)[cH:17][cH:18][c:19]([O:21][CH3:22])[cH:20]1.[CH3:33][C:34]#[N:35].[Na+:28]>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][N:6]([c:7]2[cH:8][c:9]3[c:13]([cH:14][cH:15]2)[C:12](=[O:16])[O:11][CH2:10]3)[CH3:25])[cH:17][cH:18][c:19]([O:21][CH3:22])[cH:20]1Participants
7
Sources & evidence
- ORD record
- ord-0696201f32ef47ef83b8e50cb657142a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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