Acetic Acid → 4-(4-Chlorophenyl)-4-oxobutanenitrile
Reaction equation
[CH2:13]=[CH:14][C:15]#[N:16].[CH3:17][C:18](=[O:19])[OH:20].[CH3:21][N:22]([CH3:23])[CH:24]=[O:25].[Cl:4][c:5]1[cH:6][cH:7][c:8]([CH:9]=[O:10])[cH:11][cH:12]1.[Na:1][C:2]#[N:3].[OH2:26]>>[Cl:4][c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[CH2:13][CH2:14][C:15]#[N:16])[cH:11][cH:12]1Participants
7
Sources & evidence
- ORD record
- ord-fb7ee82a7a924e429343ce8c4479f458
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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