Sodium ion → 3-(Docosanoyloxy)-4-(p-toluyloxy)phenyl tert-butylaminomethyl ketone
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][CH2:6][C:7](=[O:8])[c:9]1[cH:10][c:11]([OH:23])[c:12]([O:15][c:16]2[cH:17][cH:18][c:19]([CH3:22])[cH:20][cH:21]2)[cH:13][cH:14]1.[C:35]([CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH3:56])(=[O:57])[Cl:58].[CH3:24][O-:25].[Na+:26].[Na+:27].[O-:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][CH2:6][C:7](=[O:8])[c:9]1[cH:10][c:11]([O:23][C:35]([CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH3:56])=[O:57])[c:12]([O:15][c:16]2[cH:17][cH:18][c:19]([CH3:22])[cH:20][cH:21]2)[cH:13][cH:14]1Participants
6
Sources & evidence
- ORD record
- ord-5067f6c09e744a8e87bbb9fed6dfe029
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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