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SMILES: n1(c(=O)c(ccc1)C)CC(=O)O Canonical SMILES: Cc1cccn(c1=O)CC(=O)O InChI: InChI=1S/C8H9NO3/c1-6-3-2-4-9(8(6)12)5-7(10)11/h2-4H,5H2,1H3,(H,10,11) InChIKey: CIJDGSBMVPUFQD-UHFFFAOYSA-N
CBID:246993 http://www.chembase.cn/molecule-246993.html