Sodium Ion → HCID 178480818, 화합물
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[Br:20][CH2:21][c:22]1[c:23]([Cl:28])[cH:24][cH:25][cH:26][cH:27]1.[Cl:3][c:4]1[c:5]([C:6]#[N:7])[cH:8][cH:9][c:10]([NH:12][CH:13]2[CH2:14][N:15]([CH3:19])[C:16](=[O:18])[CH2:17]2)[cH:11]1.[H-:2].[Na+:1].[O:29]=[CH:30][N:31]([CH3:32])[CH3:33]>>[Cl:3][c:4]1[c:5]([C:6]#[N:7])[cH:8][cH:9][c:10]([N:12]([CH:13]2[CH2:14][N:15]([CH3:19])[C:16](=[O:18])[CH2:17]2)[CH2:21][c:22]2[c:23]([Cl:28])[cH:24][cH:25][cH:26][cH:27]2)[cH:11]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-b0e62f212c7e4cfeb7837117923e6731
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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