Ethyl 2-(3-hydroxyphenoxy)-2-methylpropanoate → 2-(3-{2-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclohexyl-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester
반응식
[CH2:28]([CH3:29])[O:30][C:31]([C:32]([CH3:33])([CH3:34])[O:35][c:36]1[cH:37][c:38]([OH:42])[cH:39][cH:40][cH:41]1)=[O:43].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12]2[CH:13]([CH2:14][OH:15])[CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:22][c:23]([F:27])[c:24]([F:26])[cH:25]3)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12]2[CH:13]([CH2:14][O:15][c:38]2[cH:37][c:36]([O:35][C:32]([C:31]([O:30][CH2:28][CH3:29])=[O:43])([CH3:33])[CH3:34])[cH:41][cH:40][cH:39]2)[CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:22][c:23]([F:27])[c:24]([F:26])[cH:25]3)[cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-f05e8459cb8b4dab9c74d0e66959fd7a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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