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[Br:30][C:31]([Cl:32])([Cl:33])[Cl:34].[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([C:8]([Cl:9])=[O:10])[cH:11][c:12]([O:14][C:15]([CH3:16])=[O:17])[cH:13]1.[N:18]([C:19]([CH3:20])([CH3:21])[C:22]#[N:23])=[N:24][C:25]([CH3:26])([CH3:27])[C:28]#[N:29]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([Br:30])[cH:11][c:12]([O:14][C:15]([CH3:16])=[O:17])[cH:13]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-35665c156439414e9eb11ee241c9345a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…