Sodium Ion → 1-Methyl-7-nitro-1,3,4,5-tetrahydrobenzo[b]azepin-2-one
반응식
[CH3:18][I:19].[H-:16].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[c:7]([cH:14][cH:15]1)[NH:8][C:9](=[O:13])[CH2:10][CH2:11][CH2:12]2.[Na+:17].[O:20]=[CH:21][N:22]([CH3:23])[CH3:24]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[c:7]([cH:14][cH:15]1)[N:8]([CH3:18])[C:9](=[O:13])[CH2:10][CH2:11][CH2:12]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-377b99e60f8045acaaa5427796df79ee
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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