Acetate → 2-Cyano-3-(4-methoxyphenyl)prop-2-enoic acid
Reaction equation
[C:16](#[N:17])[CH2:18][C:19](=[O:20])[OH:21].[CH3:12][C:13](=[O:14])[O-:15].[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH:1]([c:2]1[cH:3][cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1)=[O:10].[NH4+:11].[OH2:36].[nH:22]1[cH:23][cH:24][cH:25][cH:26][c:27]1=[O:28]>>[CH:1]([c:2]1[cH:3][cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1)=[C:18]([C:16]#[N:17])[C:19](=[O:20])[OH:21]Participants
8
Sources & evidence
- ORD record
- ord-91fef39c38d740978695db64403ffce1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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