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SMILES: [nH]1c(c(c(c1)C#C)C)C=O Canonical SMILES: O=Cc1[nH]cc(c1C)C#C InChI: InChI=1S/C8H7NO/c1-3-7-4-9-8(5-10)6(7)2/h1,4-5,9H,2H3 InChIKey: SETQGJWGEJYQTH-UHFFFAOYSA-N
CBID:799194 http://www.chembase.cn/molecule-799194.html