Acetic Acid → 4-[3-[3-(Tert-butyldimethylsilanyloxy)-3-(4-fluorophenyl)propyl]2-(4-methoxyphenyl)-4-oxoazetidin-1-yl]benzonitrile
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][CH2:9][CH:10]([CH:11]([c:12]1[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]1)[NH:20][c:21]1[cH:22][cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28]1)[C:29](=[O:30])[N:31]1[CH:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[CH2:39][O:40][C:41]1=[O:42])[c:43]1[cH:44][cH:45][c:46]([F:49])[cH:47][cH:48]1)([CH3:50])[CH3:51].[CH3:53][CH2:54][CH2:55][CH2:56][N+:57]([CH2:58][CH2:59][CH2:60][CH3:61])([CH2:62][CH2:63][CH2:64][CH3:65])[CH2:66][CH2:67][CH2:68][CH3:69].[CH3:70][C:71](=[O:72])[OH:73].[CH3:74][O:75][C:76]([CH3:77])([CH3:78])[CH3:79].[F-:52].[O:80]1[CH2:81][CH2:82][CH2:83][CH2:84]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][CH2:9][CH:10]1[CH:11]([c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[N:20]([c:21]2[cH:22][cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28]2)[C:29]1=[O:30])[c:43]1[cH:44][cH:45][c:46]([F:49])[cH:47][cH:48]1)([CH3:50])[CH3:51]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-cae804b8d6014291811f2584fbb6df33
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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