Acetonitrile → 1-Benzyl 4-methyl 4-allylpiperidine-1,4-dicarboxylate
반응식
[CH2:14]([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[O:21][C:22](=[O:23])[O:24][N:25]1[C:26](=[O:27])[CH2:28][CH2:29][C:30]1=[O:31].[CH2:1]([CH:2]=[CH2:3])[C:4]1([C:10](=[O:11])[O:12][CH3:13])[CH2:5][CH2:6][NH:7][CH2:8][CH2:9]1.[CH3:41][C:42]#[N:43].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40]>>[CH2:1]([CH:2]=[CH2:3])[C:4]1([C:10](=[O:11])[O:12][CH3:13])[CH2:5][CH2:6][N:7]([C:22]([O:21][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)=[O:23])[CH2:8][CH2:9]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-6523869b94474e3dabd8b06d045849eb
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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