Water → Ethyl 2-(Aminosulfonyl)benzoate
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[CH3:25][C:26]#[N:27].[Cl:1][C:2](=[O:3])[O:4][CH2:5][CH3:6].[NH2:7][c:8]1[c:9]([S:14](=[O:15])(=[O:16])[NH2:17])[cH:10][cH:11][cH:12][cH:13]1.[OH2:24].[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]1>>[C:2](=[O:3])([O:4][CH2:5][CH3:6])[c:8]1[c:9]([S:14](=[O:15])(=[O:16])[NH2:17])[cH:10][cH:11][cH:12][cH:13]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-94b960a6e43541c8b244b4f1ceedd587
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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