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SMILES: c1c2c(cc(c1Br)CO)OCO2 Canonical SMILES: OCc1cc2OCOc2cc1Br InChI: InChI=1S/C8H7BrO3/c9-6-2-8-7(11-4-12-8)1-5(6)3-10/h1-2,10H,3-4H2 InChIKey: XYYBAJXSNPIXTC-UHFFFAOYSA-N
CBID:39780 http://www.chembase.cn/molecule-39780.html