Ethanol → 2-[4-{N-(4-chlorophenyl)-N-methylaminomethyl}phenoxy]-2-methylpropionic acid
반응식
[CH3:28][CH2:29][OH:30].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]([CH3:9])[CH2:10][c:11]2[cH:12][cH:13][c:14]([O:15][C:16]([C:17](=[O:18])[O:19][CH2:20][CH3:21])([CH3:22])[CH3:23])[cH:24][cH:25]2)[cH:6][cH:7]1.[Na+:27].[OH-:26]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]([CH3:9])[CH2:10][c:11]2[cH:12][cH:13][c:14]([O:15][C:16]([C:17](=[O:18])[OH:19])([CH3:22])[CH3:23])[cH:24][cH:25]2)[cH:6][cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-c99bafa437d141fabb12c3bc73dff3b0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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