Sodium ion → HCID 178430117, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:26]([F:27])([F:28])[F:29])[cH:5][c:6]2[nH:7][c:8]([N:11]3[CH:12]([CH3:25])[CH2:13][N:14]([c:17]4[n:18][cH:19][c:20]([Cl:24])[cH:21][c:22]4[Cl:23])[CH2:15][CH2:16]3)[n:9][c:10]12.[C:43](=[O:44])([O-:45])[O-:46].[CH3:50][C:51]#[N:52].[F:30][C:31]([c:32]1[cH:33][cH:34][c:35]([B:38]([OH:39])[OH:40])[cH:36][cH:37]1)([F:41])[F:42].[Na+:47].[Na+:48].[OH2:49].[cH:53]1[cH:54][cH:55][c:56]([P:57]([Pd:58]([P:59]([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)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([P:78]([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)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[P:97]([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)[c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[cH:128][cH:129]1>>[c:2]1(-[c:35]2[cH:34][cH:33][c:32]([C:31]([F:30])([F:41])[F:42])[cH:37][cH:36]2)[cH:3][c:4]([C:26]([F:27])([F:28])[F:29])[cH:5][c:6]2[n:7][c:8]([N:11]3[CH:12]([CH3:25])[CH2:13][N:14]([c:17]4[n:18][cH:19][c:20]([Cl:24])[cH:21][c:22]4[Cl:23])[CH2:15][CH2:16]3)[nH:9][c:10]12Participants
8
Sources & evidence
- ORD record
- ord-92ccee1369d54417a03b3ffecb34b153
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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