Toluene → 4-{1-[4-(Tetrahydro-2H-pyran-2-yloxy)phenoxy]-3-butenyl}benzonitrile
Reaction equation
[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[N:28]([C:29]([N:30]1[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]1)=[O:36])=[N:37][C:38]([N:39]1[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]1)=[O:45].[O:1]1[CH:2]([O:7][c:8]2[cH:9][cH:10][c:11]([OH:14])[cH:12][cH:13]2)[CH2:3][CH2:4][CH2:5][CH2:6]1.[OH:15][CH:16]([CH2:17][CH:18]=[CH2:19])[c:20]1[cH:21][cH:22][c:23]([C:24]#[N:25])[cH:26][cH:27]1>>[O:1]1[CH:2]([O:7][c:8]2[cH:9][cH:10][c:11]([O:14][CH:16]([CH2:17][CH:18]=[CH2:19])[c:20]3[cH:21][cH:22][c:23]([C:24]#[N:25])[cH:26][cH:27]3)[cH:12][cH:13]2)[CH2:3][CH2:4][CH2:5][CH2:6]1Participants
5
Sources & evidence
- ORD record
- ord-cb6fca5e77584b6aa1ef272d294fe00d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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