Chloride → 4-(2,4-dichlorobenzoyl)-N-acetylpiperidine
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[Al+3:2].[C:5]([CH3:6])(=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([C:12](=[O:13])[Cl:14])[CH2:15][CH2:16]1.[Cl-:1].[Cl-:3].[Cl-:4].[Cl:17][c:18]1[cH:19][cH:20][cH:21][c:22]([Cl:23])[cH:24]1>>[C:5]([CH3:6])(=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([C:12](=[O:13])[c:21]2[cH:20][cH:19][c:18]([Cl:17])[cH:24][c:22]2[Cl:23])[CH2:15][CH2:16]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-176bda813bb84d5ea8243d1360b47b9d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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