반응식
[Br:22][c:23]1[c:24]([CH:29]([CH3:30])[Br:31])[cH:25][cH:26][cH:27][cH:28]1.[CH3:15][CH:16]([N-:17][CH:18]([CH3:19])[CH3:20])[CH3:21].[Li+:14].[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1.[n:1]1[cH:2][c:3]([NH:7][c:8]2[cH:9][n:10][cH:11][cH:12][cH:13]2)[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3]([N:7]([c:8]2[cH:9][n:10][cH:11][cH:12][cH:13]2)[CH:29]([c:24]2[c:23]([Br:22])[cH:28][cH:27][cH:26][cH:25]2)[CH3:30])[cH:4][cH:5][cH:6]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-55406761382f46ad9a21b33447165e4a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
연결된 노트
불러오는 중…