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SMILES: n1(c2c(c(c1)C(=O)O)ccc(c2)Br)C(=O)OC(C)(C)C Canonical SMILES: O=C(n1cc(c2c1cc(Br)cc2)C(=O)O)OC(C)(C)C InChI: InChI=1S/C14H14BrNO4/c1-14(2,3)20-13(19)16-7-10(12(17)18)9-5-4-8(15)6-11(9)16/h4-7H,1-3H3,(H,17,18) InChIKey: LBTWXBOOVSBPPC-UHFFFAOYSA-N
CBID:101790 http://www.chembase.cn/molecule-101790.html