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SMILES: n1(cc(c2c1cccc2)C=O)C(C(=O)O)CC Canonical SMILES: CCC(n1cc(c2c1cccc2)C=O)C(=O)O InChI: InChI=1S/C13H13NO3/c1-2-11(13(16)17)14-7-9(8-15)10-5-3-4-6-12(10)14/h3-8,11H,2H2,1H3,(H,16,17) InChIKey: HXWHURCYMNEHJV-UHFFFAOYSA-N
CBID:312116 http://www.chembase.cn/molecule-312116.html