반응식
[Cl:38][c:39]1[cH:40][cH:41][c:42]([CH2:45][Br:46])[cH:43][n:44]1.[N+:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][c:15]1[OH:16])([O-:17])=[O:18].[NH2:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[O-:19][N+:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27].[O:8].[OH:28][c:29]1[cH:30][cH:31][c:32]([N+:35]([O-:36])=[O:37])[cH:33][cH:34]1>>[O:28]([c:29]1[cH:30][cH:31][c:32]([N+:35]([O-:36])=[O:37])[cH:33][cH:34]1)[CH2:45][c:42]1[cH:41][cH:40][c:39]([Cl:38])[n:44][cH:43]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-e5001c88e4eb4c7cacb37d21f6128545
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…