Diethyl Ether → HCID 22405053, compound
Reaction equation
[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[CH3:56][C:57](=[O:58])[O:59][C:60](=[O:61])[CH3:62].[CH3:63][CH2:64][O:65][CH2:66][CH3:67].[CH3:71][N:72]([CH3:73])[c:74]1[cH:75][cH:76][n:77][cH:78][cH:79]1.[CH3:80][CH2:81][CH2:82][CH2:83][CH2:84][CH3:85].[Cl:68][CH2:69][Cl:70].[OH:1][CH2:2][CH2:3][N:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[CH2:12][N:13]2[C:14](=[O:48])[CH2:15][CH2:16][N:17]([C:24]([c:25]3[cH:26][cH:27][c:28]([NH:31][C:32]([c:33]4[c:34](-[c:39]5[cH:40][cH:41][c:42]([CH3:45])[cH:43][cH:44]5)[cH:35][cH:36][cH:37][cH:38]4)=[O:46])[cH:29][cH:30]3)=[O:47])[c:18]3[c:19]2[cH:20][cH:21][cH:22][cH:23]3)[CH2:8][CH2:9]1>>[O:1]([CH2:2][CH2:3][N:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[CH2:12][N:13]2[C:14](=[O:48])[CH2:15][CH2:16][N:17]([C:24]([c:25]3[cH:26][cH:27][c:28]([NH:31][C:32]([c:33]4[c:34](-[c:39]5[cH:40][cH:41][c:42]([CH3:45])[cH:43][cH:44]5)[cH:35][cH:36][cH:37][cH:38]4)=[O:46])[cH:29][cH:30]3)=[O:47])[c:18]3[c:19]2[cH:20][cH:21][cH:22][cH:23]3)[CH2:8][CH2:9]1)[C:57]([CH3:56])=[O:58]Participants
8
Sources & evidence
- ORD record
- ord-127626a928f24cba852e238aee4132e9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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