Sodium ion → 2-Nitro-5-(4-chlorophenoxy)benzonitrile
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[CH3:24][N:25]([CH3:26])[CH:27]=[O:28].[Cl:9][c:10]1[cH:11][cH:12][c:13]([N+:18](=[O:19])[O-:20])[c:14]([C:15]#[N:16])[cH:17]1.[Na+:23].[OH-:22].[OH2:21].[OH:1][c:2]1[cH:3][cH:4][c:5]([Cl:6])[cH:7][cH:8]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([Cl:6])[cH:7][cH:8]1)[c:10]1[cH:11][cH:12][c:13]([N+:18](=[O:19])[O-:20])[c:14]([C:15]#[N:16])[cH:17]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-9aa2415a5c5a44de9447e797ef9aaf3b
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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