반응식
[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:6][n:7]1[cH:8][cH:9][c:10]2[cH:11][c:12]([NH:16][c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[cH:13][cH:14][c:15]12.[Cl:1][C:2](=[O:3])[O:4][CH3:5].[Cl:23][CH2:24][Cl:25]>>[C:2](=[O:3])([O:4][CH3:5])[N:16]([c:12]1[cH:11][c:10]2[cH:9][cH:8][n:7]([CH3:6])[c:15]2[cH:14][cH:13]1)[c:17]1[cH:18][cH:19][n:20][cH:21][cH:22]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-8306c31a3da349fcb15895949e69f3fd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…