Hydrochloric Acid → 2-(4-(Trifluoromethyl)phenyl)-6-(3-(trifluoromethyl)pyridin-2-yl)-1,2-dihydroindazol-3-one
반응식
[CH3:40][CH2:41][OH:42].[ClH:39].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[n:9]2[n:10]([CH2:29][O:30][CH2:31][CH2:32][Si:33]([CH3:34])([CH3:35])[CH3:36])[c:11]3[cH:12][c:13](-[c:19]4[n:20][cH:21][cH:22][cH:23][c:24]4[C:25]([F:26])([F:27])[F:28])[cH:14][cH:15][c:16]3[c:17]2=[O:18])[cH:7][cH:8]1)([F:37])[F:38]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[n:9]2[nH:10][c:11]3[cH:12][c:13](-[c:19]4[n:20][cH:21][cH:22][cH:23][c:24]4[C:25]([F:26])([F:27])[F:28])[cH:14][cH:15][c:16]3[c:17]2=[O:18])[cH:7][cH:8]1)([F:37])[F:38]참가 물질
4
출처 및 근거
- ORD 기록
- ord-5d4bed4e88b941e383f0872a05b3dac2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)