Water → 4-(Cyclohexylamino)-3-nitrobenzonitrile
Reaction equation
[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:28][C:29]#[N:30].[Cl:1][c:2]1[c:3]([N+:10](=[O:11])[O-:12])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[NH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1.[OH2:27]>>[c:2]1([NH:13][CH:14]2[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]2)[c:3]([N+:10](=[O:11])[O-:12])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-4e1d58997acd4391b484654592b880da
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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