반응식
[C-:18]#[N:19].[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:14]([cH:15][cH:16]1)-[c:13]1[c:8]([cH:9][c:10]([Br:17])[cH:11][cH:12]1)[CH2:7]2.[Cl:21][CH2:22][Cl:23].[NH3:20].[cH:24]1[cH:25][c:26]2[c:27]([n:28][cH:29][cH:30][cH:31]2)[cH:32][cH:33]1>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:14]([cH:15][cH:16]1)-[c:13]1[c:8]([cH:9][c:10]([C:18]#[N:19])[cH:11][cH:12]1)[CH2:7]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-a36a9f69f749481481a7591ca44389cd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…