4-(Bromomethyl)benzonitrile → HCID 68644168, compound
Reaction equation
[Br:28][CH2:29][c:30]1[cH:31][cH:32][c:33]([C:36]#[N:37])[cH:34][cH:35]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][c:9]1[cH:10][n:11][c:12]([CH3:18])[c:13]([OH:17])[c:14]1[CH2:15][OH:16])[c:19]1[cH:20][cH:21][c:22]([C:25]#[N:26])[cH:23][cH:24]1)=[O:27]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][c:9]1[cH:10][n:11][c:12]([CH3:18])[c:13]([O:17][CH2:29][c:30]2[cH:31][cH:32][c:33]([C:36]#[N:37])[cH:34][cH:35]2)[c:14]1[CH2:15][OH:16])[c:19]1[cH:20][cH:21][c:22]([C:25]#[N:26])[cH:23][cH:24]1)=[O:27]Participants
3
Sources & evidence
- ORD record
- ord-d596c66f3138490097441ac567eba8b7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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