Sodium Ion → 2-Methyl-4-nitroaniline
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[CH2:1]([O:2][C:3](=[O:4])[NH:11][c:12]1[c:13]([CH3:21])[cH:14][c:15]([N+:18](=[O:19])[O-:20])[cH:16][cH:17]1)[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[Na+:28].[Na+:29].[S:22]([S:23]([O-:24])=[O:25])([O-:26])=[O:27]>>[NH2:11][c:12]1[c:13]([CH3:21])[cH:14][c:15]([N+:18](=[O:19])[O-:20])[cH:16][cH:17]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-3c22a41a39064d5095dd0c502fde200b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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