반응식
[C:27](=[O:28])([O-:29])[O-:30].[CH3:55][C:56]#[N:57].[Cl:35][CH2:36][c:37]1[cH:38][c:39](-[c:43]2[cH:44][c:45]([O:53][CH3:54])[c:46]([O:51][CH3:52])[c:47]([O:49][CH3:50])[cH:48]2)[n:40][cH:41][cH:42]1.[I-:34].[K+:31].[K+:32].[K+:33].[O:1]=[C:2]1[N:3]([CH2:8][c:9]2[cH:10][c:11](-[c:15]3[cH:16][c:17]([O:25][CH3:26])[c:18]([O:23][CH3:24])[c:19]([O:21][CH3:22])[cH:20]3)[n:12][cH:13][cH:14]2)[CH2:4][CH2:5][NH:6][CH2:7]1>>[ClH:35].[O:1]=[C:2]1[N:3]([CH2:8][c:9]2[cH:10][c:11](-[c:15]3[cH:16][c:17]([O:25][CH3:26])[c:18]([O:23][CH3:24])[c:19]([O:21][CH3:22])[cH:20]3)[n:12][cH:13][cH:14]2)[CH2:4][CH2:5][N:6]([CH2:36][c:37]2[cH:38][c:39](-[c:43]3[cH:44][c:45]([O:53][CH3:54])[c:46]([O:51][CH3:52])[c:47]([O:49][CH3:50])[cH:48]3)[n:40][cH:41][cH:42]2)[CH2:7]1참가 물질
8
반응물 6
생성물 2
출처 및 근거
- ORD 기록
- ord-d117016d4ea54003a880cc324b31947b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…