Acetonitrile → N-(1-(3,5-dichlorophenyl)ethyl)-5-fluoro-2-nitrobenzenamine
반응식
[CH3:32][C:33]#[N:34].[CH:23]([N:24]([CH2:25][CH3:26])[CH:27]([CH3:28])[CH3:29])([CH3:30])[CH3:31].[Cl:12][c:13]1[cH:14][c:15]([CH:20]([CH3:21])[NH2:22])[cH:16][c:17]([Cl:19])[cH:18]1.[F:1][c:2]1[c:3]([N+:9](=[O:10])[O-:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[c:2]1([NH:22][CH:20]([c:15]2[cH:14][c:13]([Cl:12])[cH:18][c:17]([Cl:19])[cH:16]2)[CH3:21])[c:3]([N+:9](=[O:10])[O-:11])[cH:4][cH:5][c:6]([F:8])[cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-344c3a51da364795b1207057054a2ba6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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