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SMILES: c1(c2c(cc(c1Br)CCC(=O)O)CCO2)Br Canonical SMILES: OC(=O)CCc1cc2CCOc2c(c1Br)Br InChI: InChI=1S/C11H10Br2O3/c12-9-6(1-2-8(14)15)5-7-3-4-16-11(7)10(9)13/h5H,1-4H2,(H,14,15) InChIKey: FJDCBSDUAYMTAF-UHFFFAOYSA-N
CBID:166963 http://www.chembase.cn/molecule-166963.html