반응식
[C:20]([CH:21]=[CH:22][CH3:23])#[N:24].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:9]([C:10]#[N:11])[N:12]2[CH2:13][CH2:14][O:15][CH2:16][CH2:17]2)[cH:6][cH:7][cH:8]1)([F:18])[F:19].[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:9]([C:10]#[N:11])([N:12]2[CH2:13][CH2:14][O:15][CH2:16][CH2:17]2)[CH:22]([CH2:21][C:20]#[N:24])[CH3:23])[cH:6][cH:7][cH:8]1)([F:18])[F:19]참가 물질
4
출처 및 근거
- ORD 기록
- ord-86075909e95c436e932067c91025eebc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…