Potassium Cation → Methyl 2-(2-bromo-5-(3-nitro-4-(phenylethynyl)benzoyl)thiophen-3-yl)acetate
Reaction equation
[Br:1][c:2]1[s:3][c:4]([C:12]([c:13]2[cH:14][c:15]([N+:20](=[O:21])[O-:22])[c:16]([I:19])[cH:17][cH:18]2)=[O:23])[cH:5][c:6]1[CH2:7][C:8](=[O:9])[O:10][CH3:11].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[K+:32].[K+:33].[O-:34][C:35]([O-:36])=[O:37].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH2:91].[Pd:50]([Cl:51])[Cl:52].[c:24]1([C:30]#[CH:31])[cH:25][cH:26][cH:27][cH:28][cH:29]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1.[c:72]1([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[cH:86][cH:87][cH:88][cH:89][cH:90]1>>[Br:1][c:2]1[s:3][c:4]([C:12]([c:13]2[cH:14][c:15]([N+:20](=[O:21])[O-:22])[c:16]([C:31]#[C:30][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:17][cH:18]2)=[O:23])[cH:5][c:6]1[CH2:7][C:8](=[O:9])[O:10][CH3:11]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-abcecabdb16a4d67b05df5f283dbd354
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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