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SMILES: [nH]1c(=O)c(cc(c1C)C(=O)C)C#N Canonical SMILES: N#Cc1cc(C(=O)C)c([nH]c1=O)C InChI: InChI=1S/C9H8N2O2/c1-5-8(6(2)12)3-7(4-10)9(13)11-5/h3H,1-2H3,(H,11,13) InChIKey: BPHCKZKXAHIRPD-UHFFFAOYSA-N
CBID:79308 http://www.chembase.cn/molecule-79308.html