Sodium ion → 7-Fluoro-6-nitro-4-(prop-2-yn-1-yl)-2H-1,4-benzoxazin-3(4H)-one
반응식
[CH2:18]([C:19]#[CH:20])[Br:21].[CH3:23][N:24]([CH3:25])[CH:26]=[O:27].[F:3][c:4]1[cH:5][c:6]2[c:7]([cH:13][c:14]1[N+:15](=[O:16])[O-:17])[NH:8][C:9](=[O:12])[CH2:10][O:11]2.[H-:1].[Na+:2].[OH2:22]>>[F:3][c:4]1[cH:5][c:6]2[c:7]([cH:13][c:14]1[N+:15](=[O:16])[O-:17])[N:8]([CH2:20][C:19]#[CH:18])[C:9](=[O:12])[CH2:10][O:11]2참가 물질
7
출처 및 근거
- ORD 기록
- ord-98efad97898d4ea2b5f85453cb9b16e7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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