3-Methoxybenzyl chloride → Trans 1-[4-(1,3-benzodioxol-5-yl)-1-cyclohexyl]-4-[(3-methoxyphenyl)methyl]piperazine
반응식
[CH3:22][O:23][c:24]1[cH:25][c:26]([CH2:27][Cl:28])[cH:29][cH:30][cH:31]1.[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]1[CH2:11][CH2:12][CH:13]([N:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[CH2:14][CH2:15]1)[cH:9]2>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]1[CH2:11][CH2:12][CH:13]([N:16]3[CH2:17][CH2:18][N:19]([CH2:27][c:26]4[cH:25][c:24]([O:23][CH3:22])[cH:31][cH:30][cH:29]4)[CH2:20][CH2:21]3)[CH2:14][CH2:15]1)[cH:9]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-f50430e33e2a46098e193d3af273b75e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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