Ethanol → 2-[4-Chloro-3-(methoxycarbonylaminomethyl)phenyl]-2-hydroxyiminoacetonitrile
Reaction equation
[CH3:19][CH2:20][OH:21].[CH3:29][CH2:30][O:31][C:32](=[O:33])[CH3:34].[Cl:3][c:4]1[c:5]([CH2:6][NH:7][C:8]([O:9][CH3:10])=[O:11])[cH:12][c:13]([CH2:16][C:17]#[N:18])[cH:14][cH:15]1.[N:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28].[Na+:2].[OH-:1].[OH2:35]>>[Cl:3][c:4]1[c:5]([CH2:6][NH:7][C:8]([O:9][CH3:10])=[O:11])[cH:12][c:13]([C:16]([C:17]#[N:18])=[N:22][OH:23])[cH:14][cH:15]1Participants
8
Sources & evidence
- ORD record
- ord-16db9c6056ca43a5a6fed458c7167d64
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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