4-Chloro-2-fluorobenzoic acid → Ethyl 3-(3-{[(4-chloro-2-fluorobenzoyl)amino]methyl}-4-methoxyphenyl)-2-isopropoxypropanoate
반응식
[Cl:22][c:23]1[cH:24][c:25]([F:32])[c:26]([C:27](=[O:28])[OH:29])[cH:30][cH:31]1.[NH2:1][CH2:2][c:3]1[cH:4][c:5]([CH2:11][CH:12]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[O:18][CH:19]([CH3:20])[CH3:21])[cH:6][cH:7][c:8]1[O:9][CH3:10]>>[NH:1]([CH2:2][c:3]1[cH:4][c:5]([CH2:11][CH:12]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[O:18][CH:19]([CH3:20])[CH3:21])[cH:6][cH:7][c:8]1[O:9][CH3:10])[C:27]([c:26]1[c:25]([F:32])[cH:24][c:23]([Cl:22])[cH:31][cH:30]1)=[O:28]참가 물질
3
출처 및 근거
- ORD 기록
- ord-21758164b78a4f22aa1b5ae1bd931167
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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