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SMILES: c1(cc(c(cc1)Br)C=O)C#N Canonical SMILES: O=Cc1cc(C#N)ccc1Br InChI: InChI=1S/C8H4BrNO/c9-8-2-1-6(4-10)3-7(8)5-11/h1-3,5H InChIKey: BFXZVSRDZFPABM-UHFFFAOYSA-N
CBID:797788 http://www.chembase.cn/molecule-797788.html