Water → HCID 178499549, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([F:9])[cH:5][c:6]([F:8])[cH:7]1.[CH3:11][O:12][c:13]1[cH:14][c:15]2[c:16]([CH2:23][CH2:24][CH2:25][CH:26]3[CH:27]([CH2:35][C:36](=[O:37])[O:38][CH3:39])[CH2:28][N:29]([CH2:32][C:33]#[CH:34])[CH2:30][CH2:31]3)[cH:17][cH:18][n:19][c:20]2[cH:21][cH:22]1.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[I-:10].[OH2:53].[cH:54]1[cH:55][cH:56][c:57]([P:58]([Pd:59]([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[P:98]([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)([c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[cH:129][cH:130]1>>[c:2]1([C:34]#[C:33][CH2:32][N:29]2[CH2:28][CH:27]([CH2:35][C:36](=[O:37])[O:38][CH3:39])[CH:26]([CH2:25][CH2:24][CH2:23][c:16]3[c:15]4[cH:14][c:13]([O:12][CH3:11])[cH:22][cH:21][c:20]4[n:19][cH:18][cH:17]3)[CH2:31][CH2:30]2)[cH:3][c:4]([F:9])[cH:5][c:6]([F:8])[cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-9d580b6da8144bf4970fd788371e23c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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