Ethanol → 2-[3,4-Bis(methyloxy)phenyl]-4-(methyloxy)-3-oxobutanenitrile
Reaction equation
[CH3:14][O:15][CH2:16][C:17](=[O:18])[O:19][CH2:20][CH3:21].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:11][C:12]#[N:13])[cH:6][cH:7][c:8]1[O:9][CH3:10].[CH3:23][CH2:24][O-:25].[CH3:26][CH2:27][OH:28].[Na+:22]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:11]([C:12]#[N:13])[C:17]([CH2:16][O:15][CH3:14])=[O:18])[cH:6][cH:7][c:8]1[O:9][CH3:10]Participants
6
Sources & evidence
- ORD record
- ord-90a8ae5b575845e18c9ff77bddaef78e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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