Acetonitrile → 2-{2-[4-(2-Hydroxy-ethyl)phenyl]-vinyl}-isoindole-1,3-dione
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][OH:10])[cH:6][cH:7]1.[CH3:55][C:56]#[N:57].[CH:11]([N:12]([CH:13]([CH3:14])[CH3:15])[CH2:16][CH3:17])([CH3:18])[CH3:19].[CH:20](=[CH2:21])[N:22]1[C:23](=[O:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[C:26]1=[O:27].[c:33]1([CH3:34])[cH:35][cH:36][cH:37][cH:38][c:39]1[P:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][c:46]1[CH3:47])[c:48]1[cH:49][cH:50][cH:51][cH:52][c:53]1[CH3:54]>>[c:2]1([CH:21]=[CH:20][N:22]2[C:23](=[O:32])[c:24]3[c:25]([cH:28][cH:29][cH:30][cH:31]3)[C:26]2=[O:27])[cH:3][cH:4][c:5]([CH2:8][CH2:9][OH:10])[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-cc5106d8d0de4ad4a8794e1baabe655b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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