1-[2-Chloro-4-(3-dimethylamino-2-methylpropoxy)phenyl]-1-butanone → 1-[2-Chloro-4-(3-dimethylamino-2-methylpropoxy)phenyl]-2-methylene-1-butanone
반응식
[Cl:1][CH:2]([CH2:3][CH2:4][O:5][CH2:6][CH2:7][N:8]([CH2:9][CH3:10])[CH2:11][CH3:12])[C:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)=[O:20].[Cl:21][c:22]1[c:23]([C:36]([CH2:37][CH2:38][CH3:39])=[O:40])[cH:24][cH:25][c:26]([O:28][CH2:29][CH:30]([CH2:31][N:32]([CH3:33])[CH3:34])[CH3:35])[cH:27]1>>[CH2:2]=[C:37]([C:36]([c:23]1[c:22]([Cl:21])[cH:27][c:26]([O:28][CH2:29][CH:30]([CH2:31][N:32]([CH3:33])[CH3:34])[CH3:35])[cH:25][cH:24]1)=[O:40])[CH2:38][CH3:39]참가 물질
3
출처 및 근거
- ORD 기록
- ord-17f1c79f40b44e2b9f542fdddbd7682f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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