Toluene → HCID 67163439, compound
Reaction equation
[Br:22][c:23]1[cH:24][c:25]2[c:26](=[O:37])[c:27]3[cH:28][cH:29][cH:30][n:31][c:32]3[o:33][c:34]2[cH:35][cH:36]1.[C:16](=[O:17])([O-:18])[O-:19].[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH:10]2[CH2:11][NH:12][CH2:13][CH:14]2[CH2:15]1.[CH3:94][c:95]1[cH:96][cH:97][cH:98][cH:99][cH:100]1.[Cs+:20].[Cs+:21].[O:40]=[C:41]([CH:42]=[CH:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1)[CH:50]=[CH:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[O:58]=[C:59]([CH:60]=[CH:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)[CH:68]=[CH:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[O:76]=[C:77]([CH:78]=[CH:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1)[CH:86]=[CH:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[Pd:38].[Pd:39]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH:10]2[CH2:11][N:12]([c:23]3[cH:24][c:25]4[c:26](=[O:37])[c:27]5[cH:28][cH:29][cH:30][n:31][c:32]5[o:33][c:34]4[cH:35][cH:36]3)[CH2:13][CH:14]2[CH2:15]1Participants
8
Sources & evidence
- ORD record
- ord-20c941ef5e224b2499c519ad94f77a63
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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