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SMILES: O.O=CC(=O)c1cc(ccc1)OC(C)C Canonical SMILES: O=CC(=O)c1cccc(c1)OC(C)C.O InChI: InChI=1S/C11H12O3.H2O/c1-8(2)14-10-5-3-4-9(6-10)11(13)7-12;/h3-8H,1-2H3;1H2 InChIKey: JSKNDCCAMLJKAU-UHFFFAOYSA-N
CBID:806207 http://www.chembase.cn/molecule-806207.html