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SMILES: Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)c1ccc(cc1)S(=O)(=O)O.O Canonical SMILES: Cn1c2nc([nH]c2c(=O)n(c1=O)C)c1ccc(cc1)S(=O)(=O)O.O InChI: InChI=1S/C13H12N4O5S.H2O/c1-16-11-9(12(18)17(2)13(16)19)14-10(15-11)7-3-5-8(6-4-7)23(20,21)22;/h3-6H,1-2H3,(H,14,15)(H,20,21,22);1H2 InChIKey: AYQOEZBHENEBEJ-UHFFFAOYSA-N
CBID:132876 http://www.chembase.cn/molecule-132876.html