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SMILES: O(C(=O)c1ccc(c(n1)C#N)Br)C Canonical SMILES: COC(=O)c1ccc(c(n1)C#N)Br InChI: InChI=1S/C8H5BrN2O2/c1-13-8(12)6-3-2-5(9)7(4-10)11-6/h2-3H,1H3 InChIKey: GVHAAOWHVZMDRP-UHFFFAOYSA-N
CBID:798896 http://www.chembase.cn/molecule-798896.html