Ethanol → 2-Amino-4-(3-chloropropoxy)-5-methoxybenzonitrile
반응식
[CH2:19]1[CH2:20][CH:21]=[CH:22][CH2:23][CH2:24]1.[CH3:25][CH2:26][OH:27].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([C:6]#[N:7])[cH:8][c:9]([O:17][CH3:18])[c:10]([O:12][CH2:13][CH2:14][CH2:15][Cl:16])[cH:11]1>>[NH2:1][c:4]1[c:5]([C:6]#[N:7])[cH:8][c:9]([O:17][CH3:18])[c:10]([O:12][CH2:13][CH2:14][CH2:15][Cl:16])[cH:11]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-2304ee3fb7ef4d1296862d89155254d8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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