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SMILES: O.CCOc1cc2c(N)c3ccc(N)cc3nc2cc1.CC(O)C(=O)O Canonical SMILES: OC(=O)C(O)C.CCOc1ccc2c(c1)c(N)c1c(n2)cc(cc1)N.O InChI: InChI=1S/C15H15N3O.C3H6O3.H2O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13;1-2(4)3(5)6;/h3-8H,2,16H2,1H3,(H2,17,18);2,4H,1H3,(H,5,6);1H2 InChIKey: NYEPHMYJRNWPLA-UHFFFAOYSA-N
CBID:104893 http://www.chembase.cn/molecule-104893.html