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SMILES: c1(c(c([nH]c1CBr)C(=O)OCC)C)C(=O)OCC Canonical SMILES: CCOC(=O)c1[nH]c(c(c1C)C(=O)OCC)CBr InChI: InChI=1S/C12H16BrNO4/c1-4-17-11(15)9-7(3)10(12(16)18-5-2)14-8(9)6-13/h14H,4-6H2,1-3H3 InChIKey: YFNAQTXYIOAWOW-UHFFFAOYSA-N
CBID:230734 http://www.chembase.cn/molecule-230734.html