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SMILES: n1(c(nnc1)CCC(=O)O)C Canonical SMILES: Cn1cnnc1CCC(=O)O InChI: InChI=1S/C6H9N3O2/c1-9-4-7-8-5(9)2-3-6(10)11/h4H,2-3H2,1H3,(H,10,11) InChIKey: BBTCDVHATAGJDI-UHFFFAOYSA-N
CBID:308098 http://www.chembase.cn/molecule-308098.html