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SMILES: c1(c(OCC2CC2)ccc(c1)C=O)CC Canonical SMILES: CCc1cc(C=O)ccc1OCC1CC1 InChI: InChI=1S/C13H16O2/c1-2-12-7-11(8-14)5-6-13(12)15-9-10-3-4-10/h5-8,10H,2-4,9H2,1H3 InChIKey: FZEKMQLSZVRVMC-UHFFFAOYSA-N
CBID:50112 http://www.chembase.cn/molecule-50112.html