Sodium ion → HCID 68420558, compound
Reaction equation
[Br:1][c:2]1[c:3]([O:37][CH3:38])[c:4]2[c:5](-[c:30]3[cH:31][c:32]([F:36])[cH:33][cH:34][cH:35]3)[n:6][n:7]([C:11]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[c:8]2[cH:9][cH:10]1.[C:45]([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)([c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)=[NH:58].[CH3:105][c:106]1[cH:107][cH:108][cH:109][cH:110][cH:111]1.[CH3:112][CH2:113][O:114][CH2:115][CH3:116].[CH3:39][C:40]([CH3:41])([O-:42])[CH3:43].[Na+:44].[c:59]1([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][c:70]3[c:71]([cH:72][cH:73][cH:74][cH:75]3)[c:76]2-[c:77]2[c:78]3[c:79]([cH:80][cH:81][cH:82][cH:83]3)[cH:84][cH:85][c:86]2[P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[cH:100][cH:101][cH:102][cH:103][cH:104]1>>[c:2]1([NH2:58])[c:3]([O:37][CH3:38])[c:4]2[c:5](-[c:30]3[cH:31][c:32]([F:36])[cH:33][cH:34][cH:35]3)[n:6][n:7]([C:11]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[c:8]2[cH:9][cH:10]1Participants
8
Sources & evidence
- ORD record
- ord-cb53eb6f66fa4a64be289d4539e52ea3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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