Sodium ion → 4-Chloro-6-(2,6-diethylphenyl)-2-trifluoromethyl-nicotinic acid methyl ester
Reaction equation
[CH2:17]([CH3:18])[c:19]1[c:20]([B:27]([OH:28])[OH:29])[c:21]([CH2:25][CH3:26])[cH:22][cH:23][cH:24]1.[CH3:1][O:2][C:3]([c:4]1[c:5]([C:12]([F:13])([F:14])[F:15])[n:6][c:7]([Cl:11])[cH:8][c:9]1[Cl:10])=[O:16].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Na+:30].[Na+:31].[O-:32][C:33](=[O:34])[O-:35].[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[cH:118][cH:119]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([C:12]([F:13])([F:14])[F:15])[n:6][c:7](-[c:20]2[c:19]([CH2:17][CH3:18])[cH:24][cH:23][cH:22][c:21]2[CH2:25][CH3:26])[cH:8][c:9]1[Cl:10])=[O:16]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-c8ddd550a00044a6aa28c3214b4b4915
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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