Propanoic acid, 2-bromo-2-methyl-, ethyl ester → 2-[3-(4-Chloro-phenyl)-1-dodecyl-2-methyl-1H-indole-5-yloxy]-2-methyl-propanoic acid ethylester
반응식
[CH2:31]([CH3:32])[O:33][C:34]([C:35]([CH3:36])([CH3:37])[Br:38])=[O:39].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([CH3:30])[n:10]([CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])[c:11]3[cH:12][cH:13][c:14]([OH:17])[cH:15][c:16]23)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([CH3:30])[n:10]([CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])[c:11]3[cH:12][cH:13][c:14]([O:17][C:35]([C:34]([O:33][CH2:31][CH3:32])=[O:39])([CH3:36])[CH3:37])[cH:15][c:16]23)[cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-867e0eaf45e24f35ab64efd3e91ee903
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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