1-benzyl-4-[N-ethyl-N-(3-nitro-2-pyridinyl)amino]piperidine → 1-Benzyl-4-[N-ethyl-N-(3-amino-2-pyridinyl)amino]piperidine
반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([N:14]([c:15]2[n:16][cH:17][cH:18][cH:19][c:20]2[N+:21]([O-:22])=[O:23])[CH2:24][CH3:25])[CH2:12][CH2:13]1.[CH2:26]([N:27]1[CH2:28][CH2:29][CH:30]([N:31]([CH2:32][CH2:33][CH3:34])[c:35]2[c:36]([N+:37]([O-:38])=[O:39])[cH:40][cH:41][cH:42][n:43]2)[CH2:44][CH2:45]1)[c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([N:14]([c:15]2[n:16][cH:17][cH:18][cH:19][c:20]2[NH2:21])[CH2:24][CH3:25])[CH2:12][CH2:13]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-e4c53ccb66564fda9617fa745e875d8b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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