Benzene → N-[3-(4-Methylphenyl)-1-methylpropyl]-2-hydroxy-2-(3-chlorophenyl)ethanamine
반응식
[CH3:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][C:10]([CH3:11])=[O:12])[cH:6][cH:7]1.[Cl:13][c:14]1[cH:15][c:16]([CH:20]([CH2:21][NH2:22])[OH:23])[cH:17][cH:18][cH:19]1.[cH:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH:10]([CH3:11])[NH:22][CH2:21][CH:20]([c:16]2[cH:15][c:14]([Cl:13])[cH:19][cH:18][cH:17]2)[OH:23])[cH:6][cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-b211c25031374cc882925a4d2bd29e19
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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