Sodium Ion → 2-((Cyclopropylmethoxy)methyl)-2,3-dihydro-6-nitrobenzo[b][1,4]dioxine
반응식
[Cl:18][CH2:19][CH:20]1[CH2:21][CH2:22]1.[H-:16].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[c:7]([cH:14][cH:15]1)[O:8][CH:9]([CH2:12][OH:13])[CH2:10][O:11]2.[Na+:17].[O:23]=[CH:24][N:25]([CH3:26])[CH3:27]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[c:7]([cH:14][cH:15]1)[O:8][CH:9]([CH2:12][O:13][CH2:19][CH:20]1[CH2:21][CH2:22]1)[CH2:10][O:11]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-f472343499f44e1fa7623f568eeb100c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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