Ethanol → Ethyl 2-[(3-amino-2-cyanophenyl)amino]-2-oxoacetate
반응식
[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[NH:7][c:8]1[c:9]([C:17]#[N:18])[c:10]([N+:14]([O-:15])=[O:16])[cH:11][cH:12][cH:13]1)=[O:19].[CH2:20]1[CH2:21][CH:22]=[CH:23][CH2:24][CH2:25]1.[CH3:26][CH2:27][OH:28]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[NH:7][c:8]1[c:9]([C:17]#[N:18])[c:10]([NH2:14])[cH:11][cH:12][cH:13]1)=[O:19]참가 물질
4
출처 및 근거
- ORD 기록
- ord-f2b456e9f3bc4925a7c7b382261fea61
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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