Acetic Acid → 1-(3-Aminophenyl)-5-phenyl-3-(trifluoromethyl)pyrazole
반응식
[CH3:1][C:2](=[O:3])[OH:4].[CH3:29][CH2:30][OH:31].[N+:5]([O-:6])(=[O:7])[c:8]1[cH:9][c:10](-[n:14]2[n:15][c:16]([C:25]([F:26])([F:27])[F:28])[cH:17][c:18]2-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:11][cH:12][cH:13]1>>[NH2:5][c:8]1[cH:9][c:10](-[n:14]2[n:15][c:16]([C:25]([F:26])([F:27])[F:28])[cH:17][c:18]2-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:11][cH:12][cH:13]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-3ee75764404c4fa8b5e37938a09d4781
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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