O-Xylene → HCID 16071782, compound
Reaction equation
[CH2:21]([Sn:22]([CH2:23][CH2:24][CH2:25][CH3:32])([c:26]1[n:27][cH:28][cH:29][cH:30][cH:31]1)[CH2:33][CH2:34][CH2:35][CH3:36])[CH2:37][CH2:38][CH3:39].[Cl:1][c:2]1[c:3](-[c:14]2[c:15]([Cl:20])[cH:16][n:17][cH:18][cH:19]2)[n:4][cH:5][c:6]([NH:8][C:9](=[O:10])[CH:11]2[CH2:12][CH2:13]2)[n:7]1.[c:117]1([CH3:118])[c:119]([CH3:120])[cH:121][cH:122][cH:123][cH:124]1.[cH:40]1[cH:41][cH:42][c:43]([P:44]([Pd:45]([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[cH:115][cH:116]1>>[c:2]1(-[c:26]2[n:27][cH:28][cH:29][cH:30][cH:31]2)[c:3](-[c:14]2[c:15]([Cl:20])[cH:16][n:17][cH:18][cH:19]2)[n:4][cH:5][c:6]([NH:8][C:9](=[O:10])[CH:11]2[CH2:12][CH2:13]2)[n:7]1Participants
5
Sources & evidence
- ORD record
- ord-2567cd460ddc4606810d740add57600e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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