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SMILES: CCOC(c1c(ccs1)Br)OCC Canonical SMILES: CCOC(c1sccc1Br)OCC InChI: InChI=1S/C9H13BrO2S/c1-3-11-9(12-4-2)8-7(10)5-6-13-8/h5-6,9H,3-4H2,1-2H3 InChIKey: QNTDBERHEOAJAA-UHFFFAOYSA-N
CBID:302586 http://www.chembase.cn/molecule-302586.html