Ethyl Acetate → 2-(4-amino-phenyl)-4-bromo-2H-phthalazin-1-one
반응식
[Br:1][c:2]1[n:3][n:4](-[c:13]2[cH:14][cH:15][c:16]([N+:19]([O-:20])=[O:21])[cH:17][cH:18]2)[c:5](=[O:12])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12.[CH3:22][CH2:23][O:24][C:25]([CH3:26])=[O:27]>>[Br:1][c:2]1[n:3][n:4](-[c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)[c:5](=[O:12])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12참가 물질
3
출처 및 근거
- ORD 기록
- ord-661b61e8faf04672975d629af3598c9b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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