Azobisisobutyronitrile → 4-{2-[(3-Bromomethylbenzofuran-2-carbonyl)amino]ethoxy}benzoic acid methyl ester
반응식
[Br:39][N:40]1[C:41](=[O:42])[CH2:43][CH2:44][C:45]1=[O:46].[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][CH2:11][CH2:12][NH:13][C:14](=[O:15])[c:16]2[o:17][c:18]3[c:19]([c:20]2[CH3:21])[cH:22][cH:23][cH:24][cH:25]3)[cH:8][cH:9]1)=[O:26].[Cl:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[N:27]([C:28]([CH3:29])([CH3:30])[C:31]#[N:32])=[N:33][C:34]([CH3:35])([CH3:36])[C:37]#[N:38]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][CH2:11][CH2:12][NH:13][C:14](=[O:15])[c:16]2[o:17][c:18]3[c:19]([c:20]2[CH2:21][Br:39])[cH:22][cH:23][cH:24][cH:25]3)[cH:8][cH:9]1)=[O:26]참가 물질
5
출처 및 근거
- ORD 기록
- ord-18b3dce579304079a56e80e5ccfd002d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
- DOI