Sodium Ion → 1-(2-Chloroacetyl)piperidine-4-carbonitrile
반응식
[CH3:26][N:27]([CH3:28])[CH:29]=[O:30].[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[CH2:6][CH2:7][CH:8]([C:11]([NH:13][C:12]([CH3:14])([CH3:15])[CH3:16])=[O:17])[CH2:9][CH2:10]1.[Na+:25].[OH-:24].[OH2:23].[P:18]([Cl:19])([Cl:20])([Cl:21])=[O:22]>>[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[CH2:6][CH2:7][CH:8]([C:11]#[N:13])[CH2:9][CH2:10]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-cbc861d01fe443fabae35dccde116cff
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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