Sodium ion → HCID 67312828, compound
Reaction equation
[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[Cl:16][C:17]([C:18]([Cl:19])=[O:20])=[O:21].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][cH:9][c:10]1[C:11]([CH3:12])([CH3:13])[C:14]#[N:15].[F:22][c:23]1[c:24]([O:30][c:31]2[cH:32][cH:33][c:34]([N+:37](=[O:38])[O-:39])[cH:35][cH:36]2)[cH:25][c:26]([NH2:27])[cH:28][cH:29]1.[Na+:41].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[OH-:40].[OH2:53]>>[Cl:1][c:2]1[c:3]([C:4](=[O:6])[NH:27][c:26]2[cH:25][c:24]([O:30][c:31]3[cH:32][cH:33][c:34]([N+:37](=[O:38])[O-:39])[cH:35][cH:36]3)[c:23]([F:22])[cH:29][cH:28]2)[cH:7][cH:8][cH:9][c:10]1[C:11]([CH3:12])([CH3:13])[C:14]#[N:15]Participants
10
Sources & evidence
- ORD record
- ord-da3bc99558294d438f59752fbe6cfdb6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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