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SMILES: c1ccc2cc(ccc2c1)SCCC(=O)O Canonical SMILES: OC(=O)CCSc1ccc2c(c1)cccc2 InChI: InChI=1S/C13H12O2S/c14-13(15)7-8-16-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8H2,(H,14,15) InChIKey: XMQJAJQNGNSZFY-UHFFFAOYSA-N
CBID:302020 http://www.chembase.cn/molecule-302020.html