1-(Chloromethyl)-4-fluoro-2-(trifluoromethyl)benzene → HCID 11465123, 화합물
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[CH:14]1([CH2:17][CH2:18][NH:19][C:20](=[O:21])[c:22]2[n:23][n:24][c:25]([N:28]3[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]3)[cH:26][cH:27]2)[CH2:15][CH2:16]1.[F:1][c:2]1[cH:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([CH2:6][Cl:7])[cH:8][cH:9]1>>[F:1][c:2]1[cH:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([CH2:6][N:31]2[CH2:30][CH2:29][N:28]([c:25]3[n:24][n:23][c:22]([C:20]([NH:19][CH2:18][CH2:17][CH:14]4[CH2:15][CH2:16]4)=[O:21])[cH:27][cH:26]3)[CH2:33][CH2:32]2)[cH:8][cH:9]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-27eb2a0582f241838955ea6a22805fd9
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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