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SMILES: O=C(OCC)c1c(C#N)nccc1 Canonical SMILES: CCOC(=O)c1cccnc1C#N InChI: InChI=1S/C9H8N2O2/c1-2-13-9(12)7-4-3-5-11-8(7)6-10/h3-5H,2H2,1H3 InChIKey: KOAWFXMHARNHJY-UHFFFAOYSA-N
CBID:287226 http://www.chembase.cn/molecule-287226.html