Chloride → 1-isopropyl-6-nitro-3-(3,4,5-trifluoro-phenyl)-1H-indole
Reaction equation
[CH3:120][CH2:121][OH:122].[CH3:123][c:124]1[cH:125][cH:126][cH:127][cH:128][cH:129]1.[CH:1]([CH3:2])([CH3:3])[n:4]1[cH:5][c:6]([B:16]2[O:17][C:18]([CH3:19])([CH3:20])[C:21]([CH3:22])([CH3:23])[O:24]2)[c:7]2[cH:8][cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][c:12]12.[Cl-:26].[F:27][c:28]1[cH:29][c:30]([Br:36])[cH:31][c:32]([F:35])[c:33]1[F:34].[Li+:25].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[Pd:43].[c:101]1([P:102]([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[cH:115][cH:116][cH:117][cH:118][cH:119]1.[c:44]1([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:58][cH:59][cH:60][cH:61][cH:62]1.[c:63]1([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[cH:77][cH:78][cH:79][cH:80][cH:81]1.[c:82]1([P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[cH:96][cH:97][cH:98][cH:99][cH:100]1>>[CH:1]([CH3:2])([CH3:3])[n:4]1[cH:5][c:6](-[c:30]2[cH:29][c:28]([F:27])[c:33]([F:34])[c:32]([F:35])[cH:31]2)[c:7]2[cH:8][cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][c:12]12Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-5286d41c66f44e5e9811de710d3c02c8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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