Toluene → Diethyl 2-{[2-(trifluoromethyl)anilino]methylene}malonate
반응식
[CH2:1]([O:2][CH:4]=[C:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[C:11](=[O:12])[O:13][CH2:14][CH3:15])[CH3:3].[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[F:16][C:17]([c:18]1[c:19]([NH2:20])[cH:21][cH:22][cH:23][cH:24]1)([F:25])[F:26]>>[CH:4](=[C:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[C:11](=[O:12])[O:13][CH2:14][CH3:15])[NH:20][c:19]1[c:18]([C:17]([F:16])([F:25])[F:26])[cH:24][cH:23][cH:22][cH:21]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-faa50ad3ed1a45f781817d6f083501b2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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