Ethyl Acetate → Benzoic acid, 4-amino-3,5-dimethyl-, methyl ester
반응식
[C:1](=[O:2])([O:3][CH3:4])[c:5]1[cH:6][c:7]([CH3:15])[c:8]([N+:12]([O-:13])=[O:14])[c:9]([CH3:11])[cH:10]1.[CH3:16][CH2:17][O:18][C:19](=[O:20])[CH3:21]>>[C:1](=[O:2])([O:3][CH3:4])[c:5]1[cH:6][c:7]([CH3:15])[c:8]([NH2:12])[c:9]([CH3:11])[cH:10]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-efa30c2499874b7e88234cf9d6ea020a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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