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SMILES: c1(c(cc(cc1OCC)C=O)Br)O Canonical SMILES: CCOc1cc(C=O)cc(c1O)Br InChI: InChI=1S/C9H9BrO3/c1-2-13-8-4-6(5-11)3-7(10)9(8)12/h3-5,12H,2H2,1H3 InChIKey: GWEFTCNMUHHQLP-UHFFFAOYSA-N
CBID:11212 http://www.chembase.cn/molecule-11212.html