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SMILES: c1cccc(c1OC(=O)C)SCC#CCCCC Canonical SMILES: CCCCC#CCSc1ccccc1OC(=O)C InChI: InChI=1S/C15H18O2S/c1-3-4-5-6-9-12-18-15-11-8-7-10-14(15)17-13(2)16/h7-8,10-11H,3-5,12H2,1-2H3 InChIKey: GXMBHQRROXQUJS-UHFFFAOYSA-N
CBID:169885 http://www.chembase.cn/molecule-169885.html