Carbonate Ion → 2-Fluoro-4-(3-hydroxy-2,3-dimethyl-5-oxopyrrolidin-1-yl)-3-methylbenzonitrile
Reaction equation
[Br:1][c:2]1[c:3]([CH3:11])[c:4]([F:10])[c:5]([C:6]#[N:7])[cH:8][cH:9]1.[C:63](=[O:64])([O-:65])[O-:66].[Cs+:67].[Cs+:68].[O:107]=[C:108]([CH:109]=[CH:110][c:111]1[cH:112][cH:113][cH:114][cH:115][cH:116]1)[CH:117]=[CH:118][c:119]1[cH:120][cH:121][cH:122][cH:123][cH:124]1.[O:71]=[C:72]([CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1)[CH:81]=[CH:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1.[O:89]=[C:90]([CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1)[CH:99]=[CH:100][c:101]1[cH:102][cH:103][cH:104][cH:105][cH:106]1.[OH:12][C:13]1([CH3:20])[CH2:14][C:15](=[O:19])[NH:16][CH:17]1[CH3:18].[Pd:69].[Pd:70].[c:21]1([P:22]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[c:30]3[c:54]([cH:55][cH:56][cH:57]2)[C:51]([CH3:52])([CH3:53])[c:33]2[c:32]([c:37]([P:38]([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[cH:36][cH:35][cH:34]2)[O:31]3)[cH:58][cH:59][cH:60][cH:61][cH:62]1>>[c:2]1([N:16]2[C:15](=[O:19])[CH2:14][C:13]([OH:12])([CH3:20])[CH:17]2[CH3:18])[c:3]([CH3:11])[c:4]([F:10])[c:5]([C:6]#[N:7])[cH:8][cH:9]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-c550eb6b099a45e4a19bdba6254dc5b7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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