2-(Dimethylamino)ethanol → (2-[4-(Tert-butyl)-2-nitrophenoxy]-ethyl)dimethylamine
Reaction equation
[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:27][N:28]([CH3:29])[CH2:30][CH2:31][OH:32].[CH3:57][CH2:58][O:59][C:60]([CH3:61])=[O:62].[N+:13](=[O:14])([O-:15])[c:16]1[c:17]([OH:26])[cH:18][cH:19][c:20]([C:22]([CH3:23])([CH3:24])[CH3:25])[cH:21]1.[O:1]=[C:2]([O:3][CH2:4][CH3:5])[N:6]=[N:7][C:8]([O:9][CH2:10][CH3:11])=[O:12].[c:33]1([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[N+:13](=[O:14])([O-:15])[c:16]1[c:17]([O:26][CH2:31][CH2:30][N:28]([CH3:27])[CH3:29])[cH:18][cH:19][c:20]([C:22]([CH3:23])([CH3:24])[CH3:25])[cH:21]1Participants
7
Sources & evidence
- ORD record
- ord-ee97903c83924caba90381199ef1ae3a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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