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SMILES: C1(=C(COC1=O)c1ccc(cc1)Br)C#N Canonical SMILES: N#CC1=C(COC1=O)c1ccc(cc1)Br InChI: InChI=1S/C11H6BrNO2/c12-8-3-1-7(2-4-8)10-6-15-11(14)9(10)5-13/h1-4H,6H2 InChIKey: PPOYNWDABZQQRK-UHFFFAOYSA-N
CBID:42536 http://www.chembase.cn/molecule-42536.html