Bicarbonate Ion → 4-{3-[2-(2,4-Dichloro-phenyl)-ethoxy]-4-methoxy-benzoylamino}-piperidine-1-carboxylic acid tert-butyl ester
반응식
[C:23](=[O:24])([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[N:30]1[CH2:31][CH2:32][CH:33]([NH2:36])[CH2:34][CH2:35]1.[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:16])[OH:17])[cH:18][cH:19][c:20]2[O:21][CH3:22])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:42][CH2:43][Cl:44].[Na+:41].[O-:37][C:38]([OH:39])=[O:40]>>[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:17])[NH:36][CH:33]3[CH2:32][CH2:31][N:30]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:35][CH2:34]3)[cH:18][cH:19][c:20]2[O:21][CH3:22])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-6b277124904140ef81dd3823f0a087fc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
불러오는 중…