2-(2-Bromo-4-chlorophenoxy)-2-methylpropanoate → 2-(4-Chloro-2-{[2-fluoro-5-(propylsulfonyl)phenyl]ethynyl}phenoxy)-2-methylpropanoic acid
반응식
[Br:1][c:2]1[c:3]([O:4][C:5]([C:6](=[O:7])[O-:8])([CH3:9])[CH3:10])[cH:11][cH:12][c:13]([Cl:15])[cH:14]1.[C:16](#[CH:17])[c:18]1[c:19]([F:30])[cH:20][cH:21][c:22]([S:24](=[O:25])(=[O:26])[CH2:27][CH2:28][CH3:29])[cH:23]1>>[c:2]1([C:17]#[C:16][c:18]2[c:19]([F:30])[cH:20][cH:21][c:22]([S:24](=[O:25])(=[O:26])[CH2:27][CH2:28][CH3:29])[cH:23]2)[c:3]([O:4][C:5]([C:6](=[O:7])[OH:8])([CH3:9])[CH3:10])[cH:11][cH:12][c:13]([Cl:15])[cH:14]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-961d3f44e06b424d85d4626731800177
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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