Sodium ion → 1-[5-(Morpholin-4-ylcarbonyl)-4-(trifluoromethyl)pyrimidin-2-yl]-6-nitro-1,2,3,4-tetrahydroquinoline
Reaction equation
[CH3:33][C:34]([CH3:35])([O-:36])[CH3:37].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([C:12](=[O:13])[N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[c:6]([C:8]([F:9])([F:10])[F:11])[n:7]1.[N+:20](=[O:21])([O-:22])[c:23]1[cH:24][c:25]2[c:30]([cH:31][cH:32]1)[NH:29][CH2:28][CH2:27][CH2:26]2.[Na+:38].[O:48]=[C:49]([CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[CH:58]=[CH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[O:66]=[C:67]([CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[CH:76]=[CH:77][c:78]1[cH:79][cH:80][cH:81][cH:82][cH:83]1.[O:84]=[C:85]([CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)[CH:94]=[CH:95][c:96]1[cH:97][cH:98][cH:99][cH:100][cH:101]1.[OH2:102].[Pd:46].[Pd:47]>>[c:2]1([N:29]2[CH2:28][CH2:27][CH2:26][c:25]3[cH:24][c:23]([N+:20](=[O:21])[O-:22])[cH:32][cH:31][c:30]32)[n:3][cH:4][c:5]([C:12](=[O:13])[N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[c:6]([C:8]([F:9])([F:10])[F:11])[n:7]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-a0a4ef8bda9742229b47a8e0dc67ac82
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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