Benzene → HCID 178491384, compound
Reaction equation
[C:94]([O:95][CH2:96][CH3:97])(=[O:98])[CH3:99].[CH2:71]([N+:72]([CH2:73][CH2:74][CH2:75][CH3:76])([CH2:77][CH2:78][CH2:79][CH3:80])[CH2:81][CH2:82][CH2:83][CH3:84])[CH2:85][CH2:86][CH3:87].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:7]([c:8]2[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]2)([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[O:22][CH2:23][C:24]2([CH:46]=[CH:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][O:53][S:54]([CH3:55])(=[O:56])=[O:57])[CH:25]([O:38][SiH2:39][C:40]([CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45])[CH2:26][CH:27]([n:29]3[c:30](=[O:31])[nH:32][c:33](=[O:34])[c:35]([CH3:36])[cH:37]3)[O:28]2)[cH:58][cH:59]1.[CH3:88][CH2:89][CH2:90][CH2:91][CH2:92][CH3:93].[I-:70].[N-:61]=[N+:62]=[N-:63].[Na+:60].[cH:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:7]([c:8]2[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]2)([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[O:22][CH2:23][C:24]2([CH:46]=[CH:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][N:61]=[N+:62]=[N-:63])[CH:25]([O:38][SiH2:39][C:40]([CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45])[CH2:26][CH:27]([n:29]3[c:30](=[O:31])[nH:32][c:33](=[O:34])[c:35]([CH3:36])[cH:37]3)[O:28]2)[cH:58][cH:59]1Participants
9
Sources & evidence
- ORD record
- ord-93972198a0504f2d896248a8f8cb16f7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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