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SMILES: c1(sc2c(c1)CCCC2)C(=O)O Canonical SMILES: OC(=O)c1cc2c(s1)CCCC2 InChI: InChI=1S/C9H10O2S/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h5H,1-4H2,(H,10,11) InChIKey: ROLXOQXKNDKXTA-UHFFFAOYSA-N
CBID:17738 http://www.chembase.cn/molecule-17738.html