Sodium ion → 2-[2-[4-[(4-Chlorophenyl)-2-pyridylmethoxy]-1-piperidyl]ethoxy]benzoxazole
반응식
[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([O:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][OH:18])[CH2:14][CH2:15]2)[c:19]2[n:20][cH:21][cH:22][cH:23][cH:24]2)[cH:6][cH:7]1.[Cl:27][c:28]1[o:29][c:30]2[c:31]([n:32]1)[cH:33][cH:34][cH:35][cH:36]2.[H-:25].[Na+:26]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([O:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][O:18][c:28]3[o:29][c:30]4[c:31]([n:32]3)[cH:33][cH:34][cH:35][cH:36]4)[CH2:14][CH2:15]2)[c:19]2[n:20][cH:21][cH:22][cH:23][cH:24]2)[cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-2c84621e39d64328b9a0077e3115e6b3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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