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SMILES: s1c(c(c(c1)C(=O)O)Br)C(=O)O Canonical SMILES: OC(=O)c1scc(c1Br)C(=O)O InChI: InChI=1S/C6H3BrO4S/c7-3-2(5(8)9)1-12-4(3)6(10)11/h1H,(H,8,9)(H,10,11) InChIKey: MEDPKIVWBXQFAW-UHFFFAOYSA-N
CBID:92133 http://www.chembase.cn/molecule-92133.html