Acetic Acid → 3-[3-[3-(tert-Butyldimethylsilanyloxy)-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-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]([NH:12][c:13]1[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]1)[c:20]1[cH:21][c:22]([C:23]#[N:24])[cH:25][cH:26][cH:27]1)[C:28](=[O:29])[N:30]1[CH:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:38][O:39][C:40]1=[O:41])[c:42]1[cH:43][cH:44][c:45]([F:48])[cH:46][cH:47]1)([CH3:49])[CH3:50].[CH3:51][Si:52]([CH:53]([Si:54]([CH3:55])([CH3:56])[CH3:57])[C:58]([NH2:59])=[O:60])([CH3:61])[CH3:62].[CH3:64][CH2:65][CH2:66][CH2:67][N+:68]([CH2:69][CH2:70][CH2:71][CH3:72])([CH2:73][CH2:74][CH2:75][CH3:76])[CH2:77][CH2:78][CH2:79][CH3:80].[CH3:81][O:82][C:83]([CH3:84])([CH3:85])[CH3:86].[CH3:87][C:88](=[O:89])[OH:90].[F-:63]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][CH2:9][CH:10]1[CH:11]([c:20]2[cH:21][c:22]([C:23]#[N:24])[cH:25][cH:26][cH:27]2)[N:12]([c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[C:28]1=[O:29])[c:42]1[cH:43][cH:44][c:45]([F:48])[cH:46][cH:47]1)([CH3:49])[CH3:50]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-1861b33f5c0540b3ad736eff8b0c5fb9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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