Hydrochloric Acid → Benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester
반응식
[CH2:19]1[CH2:22][CH2:21][CH2:20][O:23]1.[CH3:13][CH2:14][O:15][C:16]([CH3:17])=[O:18].[ClH:12].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:8]#[N:9])[cH:10][cH:11]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:8]([CH2:17][C:16]([O:15][CH2:14][CH3:13])=[O:18])=[O:23])[cH:10][cH:11]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-e8ea55ac63a141f395fea64e87a31371
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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