Acetonitrile → 4-Bromo-2-cyclopropylaminomethyl-benzoic acid isopropyl ester
반응식
[CH3:20][C:21]#[N:22].[CH:16]1([NH2:19])[CH2:17][CH2:18]1.[CH:1]([CH3:2])([CH3:3])[O:4][C:5]([c:6]1[c:7]([CH2:13][Br:14])[cH:8][c:9]([Br:12])[cH:10][cH:11]1)=[O:15]>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5]([c:6]1[c:7]([CH2:13][NH:19][CH:16]2[CH2:17][CH2:18]2)[cH:8][c:9]([Br:12])[cH:10][cH:11]1)=[O:15]참가 물질
4
출처 및 근거
- ORD 기록
- ord-40d07e8422ba40fb82740fd438f4d604
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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