Sodium ion → HCID 25096029, compound
Reaction equation
[CH3:31][n:32]1[n:33][cH:34][c:35]([B:37]2[O:38][C:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[O:45]2)[cH:36]1.[Cl:1][c:2]1[c:3]2[cH:4][c:5]([CH2:19][n:20]3[n:21][c:22]([I:30])[c:23]4[c:24]3[n:25][cH:26][n:27][c:28]4[NH2:29])[c:6](-[c:12]3[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]3)[n:7][c:8]2[cH:9][cH:10][cH:11]1.[Na+:46].[Na+:47].[O-:48][C:49](=[O:50])[O-:51].[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1>>[Cl:1][c:2]1[c:3]2[cH:4][c:5]([CH2:19][n:20]3[n:21][c:22](-[c:35]4[cH:34][n:33][n:32]([CH3:31])[cH:36]4)[c:23]4[c:24]3[n:25][cH:26][n:27][c:28]4[NH2:29])[c:6](-[c:12]3[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]3)[n:7][c:8]2[cH:9][cH:10][cH:11]1Participants
7
Sources & evidence
- ORD record
- ord-9870b5512d074f1fbd0bc5232d82e256
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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