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SMILES: c1(=O)[nH]c2c([nH]1)ccc(C#N)c2 Canonical SMILES: N#Cc1ccc2c(c1)[nH]c(=O)[nH]2 InChI: InChI=1S/C8H5N3O/c9-4-5-1-2-6-7(3-5)11-8(12)10-6/h1-3H,(H2,10,11,12) InChIKey: HMERLJKYKSAIMU-UHFFFAOYSA-N
CBID:238021 http://www.chembase.cn/molecule-238021.html