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SMILES: c1(c(cc(cc1OCC)C=O)Br)OCC Canonical SMILES: CCOc1cc(C=O)cc(c1OCC)Br InChI: InChI=1S/C11H13BrO3/c1-3-14-10-6-8(7-13)5-9(12)11(10)15-4-2/h5-7H,3-4H2,1-2H3 InChIKey: YPBFTPYBXACRPN-UHFFFAOYSA-N
CBID:26102 http://www.chembase.cn/molecule-26102.html