Chloride → 4-Isopropyl-2-nitrobenzonitrile
Reaction equation
[Br:1][c:2]1[c:3]([N+:11](=[O:12])[O-:13])[cH:4][c:5]([CH:8]([CH3:9])[CH3:10])[cH:6][cH:7]1.[CH3:17][N:18]([CH3:19])[CH:20]=[O:21].[Cl-:30].[Cl-:32].[Cl-:33].[ClH:23].[Cu:14][C:15]#[N:16].[Fe+3:31].[OH2:22].[OH2:24].[OH2:25].[OH2:26].[OH2:27].[OH2:28].[OH2:29]>>[c:2]1([C:15]#[N:16])[c:3]([N+:11](=[O:12])[O-:13])[cH:4][c:5]([CH:8]([CH3:9])[CH3:10])[cH:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-46e79f2cd44d4249874325329c7beb37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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