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SMILES: O=C(c1cc2occ(Br)c2[nH]1)OCC Canonical SMILES: CCOC(=O)c1cc2c([nH]1)c(co2)Br InChI: InChI=1S/C9H8BrNO3/c1-2-13-9(12)6-3-7-8(11-6)5(10)4-14-7/h3-4,11H,2H2,1H3 InChIKey: BRCYQLJSKNOAFL-UHFFFAOYSA-N
CBID:289897 http://www.chembase.cn/molecule-289897.html