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SMILES: c1(nc(c(cn1)Br)C(=O)O)C Canonical SMILES: Cc1ncc(c(n1)C(=O)O)Br InChI: InChI=1S/C6H5BrN2O2/c1-3-8-2-4(7)5(9-3)6(10)11/h2H,1H3,(H,10,11) InChIKey: MDERWSRHRJUWNS-UHFFFAOYSA-N
CBID:66705 http://www.chembase.cn/molecule-66705.html