Sodium ion → 5-Chloro-3-(3-methoxy-2-tritylaminopropoxy)-1,2-benzoisoxazole
Reaction equation
[CH3:38][I:39].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[Cl:3][c:4]1[cH:5][cH:6][c:7]2[c:8]([c:9]([O:12][CH2:13][CH:14]([CH2:15][OH:16])[NH:17][C:18]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[n:10][o:11]2)[cH:37]1.[H-:1].[Na+:2].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1>>[Cl:3][c:4]1[cH:5][cH:6][c:7]2[c:8]([c:9]([O:12][CH2:13][CH:14]([CH2:15][O:16][CH3:40])[NH:17][C:18]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[n:10][o:11]2)[cH:37]1Participants
7
Sources & evidence
- ORD record
- ord-147fc0e78c4644d9984fbde49a69e467
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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