Acetone → 3-(3',3''-Dibenzyl-4''-(cyanomethoxy)-2-isobutyl-1,1':4',1''-terphenyl-4-yl)propanenitrile
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10](-[c:28]2[c:29]([CH2:38][CH:39]([CH3:40])[CH3:41])[cH:30][c:31]([CH2:34][CH2:35][C:36]#[N:37])[cH:32][cH:33]2)[cH:11][cH:12][c:13]1-[c:14]1[cH:15][c:16]([CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:17]([OH:20])[cH:18][cH:19]1.[CH3:52][C:53](=[O:54])[CH3:55].[Cl:48][CH2:49][C:50]#[N:51].[K+:42].[K+:43].[O-:44][C:45]([O-:46])=[O:47]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10](-[c:28]2[c:29]([CH2:38][CH:39]([CH3:40])[CH3:41])[cH:30][c:31]([CH2:34][CH2:35][C:36]#[N:37])[cH:32][cH:33]2)[cH:11][cH:12][c:13]1-[c:14]1[cH:15][c:16]([CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:17]([O:20][CH2:49][C:50]#[N:51])[cH:18][cH:19]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-58c48be42be945989b0cdb1fc2cc9055
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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