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SMILES: n1c(c(cc(c1)Br)C(=O)OC)O Canonical SMILES: COC(=O)c1cc(Br)cnc1O InChI: InChI=1S/C7H6BrNO3/c1-12-7(11)5-2-4(8)3-9-6(5)10/h2-3H,1H3,(H,9,10) InChIKey: TXZVFXMZHYRSDN-UHFFFAOYSA-N
CBID:90994 http://www.chembase.cn/molecule-90994.html