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SMILES: COc1ccccc1CNCCc1c2CCOc2c(Br)c2CCOc12 Canonical SMILES: COc1ccccc1CNCCc1c2OCCc2c(c2c1CCO2)Br InChI: InChI=1S/C20H22BrNO3/c1-23-17-5-3-2-4-13(17)12-22-9-6-14-15-7-10-25-20(15)18(21)16-8-11-24-19(14)16/h2-5,22H,6-12H2,1H3 InChIKey: CUFCITSPWAZWHS-UHFFFAOYSA-N
CBID:125335 http://www.chembase.cn/molecule-125335.html