Acetic Acid → 5-Methoxy-4-[(1-methylpiperidin-4-yl)methoxy]-2-nitrobenzonitrile
Reaction equation
[CH2:22]=[O:23].[CH3:24][C:25](=[O:26])[OH:27].[CH3:31][OH:32].[Cl:28][CH2:29][Cl:30].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([C:6]#[N:7])[cH:8][c:9]([O:20][CH3:21])[c:10]([O:12][CH2:13][CH:14]2[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]2)[cH:11]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([C:6]#[N:7])[cH:8][c:9]([O:20][CH3:21])[c:10]([O:12][CH2:13][CH:14]2[CH2:15][CH2:16][N:17]([CH3:24])[CH2:18][CH2:19]2)[cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-e1a8027bc7b84c5e8c223f3feee1f09c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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