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SMILES: c1(onc(c1)CCC)C(=O)O Canonical SMILES: CCCc1cc(on1)C(=O)O InChI: InChI=1S/C7H9NO3/c1-2-3-5-4-6(7(9)10)11-8-5/h4H,2-3H2,1H3,(H,9,10) InChIKey: JHEZCMNYXDKGTQ-UHFFFAOYSA-N
CBID:30966 http://www.chembase.cn/molecule-30966.html