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SMILES: c1(c(=O)[nH]c(cc1)C(C)C)C#N Canonical SMILES: N#Cc1ccc([nH]c1=O)C(C)C InChI: InChI=1S/C9H10N2O/c1-6(2)8-4-3-7(5-10)9(12)11-8/h3-4,6H,1-2H3,(H,11,12) InChIKey: XQEKXIYVPKTHAB-UHFFFAOYSA-N
CBID:50758 http://www.chembase.cn/molecule-50758.html