1,2-Dimethoxyethane → C31H26Cl2N2O3
Reaction equation
[CH2:57]([CH2:58][O:59][CH3:60])[O:61][CH3:62].[CH3:35][O:36][c:37]1[cH:38][c:39]2[cH:40][cH:41][c:42]([B:47]([OH:48])[OH:49])[cH:43][c:44]2[cH:45][cH:46]1.[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[Cl:1][c:2]1[cH:3][c:4](-[c:9]2[n:10][n:11]([CH:22]([CH3:23])[c:24]3[cH:25][cH:26][c:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:33][cH:34]3)[c:12]([O:14][S:15]([C:16]([F:17])([F:18])[F:19])(=[O:20])=[O:21])[cH:13]2)[cH:5][c:6]([Cl:8])[cH:7]1>>[Cl:1][c:2]1[cH:3][c:4](-[c:9]2[n:10][n:11]([CH:22]([CH3:23])[c:24]3[cH:25][cH:26][c:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:33][cH:34]3)[c:12](-[c:42]3[cH:41][cH:40][c:39]4[cH:38][c:37]([O:36][CH3:35])[cH:46][cH:45][c:44]4[cH:43]3)[cH:13]2)[cH:5][c:6]([Cl:8])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-910322f0d42245eabf699bf69ea47f28
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)