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SMILES: c1(cc(no1)C(C)C)C(=O)O Canonical SMILES: CC(c1noc(c1)C(=O)O)C InChI: InChI=1S/C7H9NO3/c1-4(2)5-3-6(7(9)10)11-8-5/h3-4H,1-2H3,(H,9,10) InChIKey: GYOKWSOCMUDVGN-UHFFFAOYSA-N
CBID:18986 http://www.chembase.cn/molecule-18986.html