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SMILES: O=C(CCc1ccc(cc1)Br)O Canonical SMILES: OC(=O)CCc1ccc(cc1)Br InChI: InChI=1S/C9H9BrO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H,11,12) InChIKey: NCSTWHYWOVZDOC-UHFFFAOYSA-N
CBID:8924 http://www.chembase.cn/molecule-8924.html