Potassium Cation → 3-Chloro-5-(4-methyl-piperazin-1-yl)-benzonitrile
반응식
[CH3:11][N:12]1[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]1.[Cl:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([F:10])[cH:9]1.[K+:18].[K+:19].[O-:20][C:21]([O-:22])=[O:23].[O:24]=[CH:25][N:26]([CH3:27])[CH3:28]>>[Cl:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([N:15]2[CH2:14][CH2:13][N:12]([CH3:11])[CH2:17][CH2:16]2)[cH:9]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-a3f78aa5fd974315bbc5c6ec6c29100a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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