Toluene → HCID 68663305, compound
Reaction equation
[CH2:15]([Sn:16]([CH2:17][CH2:18][CH2:19][CH3:26])([c:20]1[n:21][cH:22][cH:23][cH:24][cH:25]1)[CH2:27][CH2:28][CH2:29][CH3:30])[CH2:31][CH2:32][CH3:33].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[I:1][c:2]1[cH:3][n:4][c:5]2[n:6]1[cH:7][c:8]([C:11](=[O:12])[O:13][CH3:14])[cH:9][cH:10]2.[cH:47]1[cH:48][cH:49][c:50]([P:51]([Pd:52]([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([P:72]([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[P:91]([c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)([c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[cH:122][cH:123]1>>[c:2]1(-[c:20]2[n:21][cH:22][cH:23][cH:24][cH:25]2)[cH:3][n:4][c:5]2[n:6]1[cH:7][c:8]([C:11](=[O:12])[O:13][CH3:14])[cH:9][cH:10]2Participants
6
Sources & evidence
- ORD record
- ord-098eefc0b1c44d33a1bc4a2904c27e4a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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