Acetic Acid → 1-[2-(4-Methyl-piperazin-1-yl-methyl)phenyl]-ethanone
반응식
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([CH:6]=[O:7])[cH:8][cH:9][cH:10][cH:11]1.[CH3:12][N:13]1[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]1.[CH3:19][C:20](=[O:21])[OH:22].[Cl:23][CH2:24][Cl:25]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([CH2:6][N:16]2[CH2:15][CH2:14][N:13]([CH3:12])[CH2:18][CH2:17]2)[cH:8][cH:9][cH:10][cH:11]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-e81e4b411cd04f69bef6c1fbe4fb03a3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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