Hydrochloric Acid → 4-((3-(5-Methyl-1H-tetrazol-1-yl)-5-(trifluoromethyl)benzyloxy)methyl)-4-phenylpiperidine
반응식
[CH3:1][c:2]1[n:3][n:4][n:5][n:6]1-[c:7]1[cH:8][c:9]([CH2:10][O:11][CH2:12][C:13]2([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:14][CH2:15][N:16]([C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25])[CH2:17][CH2:18]2)[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]1.[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[ClH:39]>>[CH3:1][c:2]1[n:3][n:4][n:5][n:6]1-[c:7]1[cH:8][c:9]([CH2:10][O:11][CH2:12][C:13]2([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]2)[cH:32][c:33]([C:35]([F:36])([F:37])[F:38])[cH:34]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-3dda0f00b7c54fe1b64c05015ea72299
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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