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SMILES: c1(=O)[nH]c(=O)c(cn1c1ccc(cc1)OC)C#N Canonical SMILES: COc1ccc(cc1)n1cc(C#N)c(=O)[nH]c1=O InChI: InChI=1S/C12H9N3O3/c1-18-10-4-2-9(3-5-10)15-7-8(6-13)11(16)14-12(15)17/h2-5,7H,1H3,(H,14,16,17) InChIKey: IUHGJPXHOBKFCM-UHFFFAOYSA-N
CBID:39702 http://www.chembase.cn/molecule-39702.html