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SMILES: c1(CC(=O)C)cc(Br)ccc1 Canonical SMILES: CC(=O)Cc1cccc(c1)Br InChI: InChI=1S/C9H9BrO/c1-7(11)5-8-3-2-4-9(10)6-8/h2-4,6H,5H2,1H3 InChIKey: FQIZFAJMBXZVOL-UHFFFAOYSA-N
CBID:239483 http://www.chembase.cn/molecule-239483.html