Sodium Ion → 4-(3-Bromo-5-methoxyphenoxy)-1-methylpiperidine
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[Br:11][c:12]1[cH:13][c:14]([O:19][CH3:20])[cH:15][c:16]([F:18])[cH:17]1.[H-:1].[Na+:2].[O:22]=[CH:23][N:24]([CH3:25])[CH3:26].[OH2:21].[OH:3][CH:4]1[CH2:5][CH2:6][N:7]([CH3:10])[CH2:8][CH2:9]1>>[O:3]([CH:4]1[CH2:5][CH2:6][N:7]([CH3:10])[CH2:8][CH2:9]1)[c:16]1[cH:15][c:14]([O:19][CH3:20])[cH:13][c:12]([Br:11])[cH:17]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-73f6367495bf436fb5354e92b8141fd5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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