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SMILES: s1c(c2c(c1C=O)OCCO2)Br Canonical SMILES: O=Cc1sc(c2c1OCCO2)Br InChI: InChI=1S/C7H5BrO3S/c8-7-6-5(4(3-9)12-7)10-1-2-11-6/h3H,1-2H2 InChIKey: YEKBJVHBVICUOZ-UHFFFAOYSA-N
CBID:92184 http://www.chembase.cn/molecule-92184.html