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SMILES: c1(c(c2ccc(cc2[nH]1)C(=O)OC)C1C(CCCC1)F)Br Canonical SMILES: COC(=O)c1ccc2c(c1)[nH]c(c2C1CCCCC1F)Br InChI: InChI=1S/C16H17BrFNO2/c1-21-16(20)9-6-7-11-13(8-9)19-15(17)14(11)10-4-2-3-5-12(10)18/h6-8,10,12,19H,2-5H2,1H3 InChIKey: FQQSJXAZKIBOKN-UHFFFAOYSA-N
CBID:799459 http://www.chembase.cn/molecule-799459.html