Toluene → 7-(acetylamino)-9a-butyl-8-chloro-6-fluoro4-(2-furyl)-1,2,9,9a-tetrahydro-3H-fluoren-3-one
Reaction equation
[C:19]([CH3:20])(=[O:21])[NH:22][c:23]1[c:24]([F:43])[cH:25][c:26]2[c:34]([c:35]1[Cl:36])[CH2:33][C:32]1([CH2:37][CH2:38][CH2:39][CH3:40])[C:27]2=[C:28]([Br:42])[C:29](=[O:41])[CH2:30][CH2:31]1.[CH2:1]([Sn:2]([CH2:3][CH2:4][CH2:5][CH3:11])([c:6]1[o:7][cH:8][cH:9][cH:10]1)[CH2:12][CH2:13][CH2:14][CH3:15])[CH2:16][CH2:17][CH3:18].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Pd:51]([Cl:52])[Cl:53].[c:54]1([P:55]([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)[cH:68][cH:69][cH:70][cH:71][cH:72]1.[c:73]1([P:74]([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)[cH:87][cH:88][cH:89][cH:90][cH:91]1>>[c:6]1([C:28]2=[C:27]3[c:26]4[cH:25][c:24]([F:43])[c:23]([NH:22][C:19]([CH3:20])=[O:21])[c:35]([Cl:36])[c:34]4[CH2:33][C:32]3([CH2:37][CH2:38][CH2:39][CH3:40])[CH2:31][CH2:30][C:29]2=[O:41])[o:7][cH:8][cH:9][cH:10]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-f31b639a0a2d4a8792252e82fba68f55
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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