Ethyl Acetate → 4-Hydroxy-1-p-tolyl-isoquinoline-3-carboxylic acid butyl ester
반응식
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10](-[c:26]2[cH:27][cH:28][c:29]([CH3:32])[cH:30][cH:31]2)[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[c:17]1[O:18][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][c:10](-[c:26]2[cH:27][cH:28][c:29]([CH3:32])[cH:30][cH:31]2)[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[c:17]1[OH:18]참가 물질
3
출처 및 근거
- ORD 기록
- ord-28cb11bcbdb947c489f41144dd740d74
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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