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SMILES: c1(c(n2c(nc1C)ccn2)C)C(=O)O Canonical SMILES: OC(=O)c1c(C)nc2n(c1C)ncc2 InChI: InChI=1S/C9H9N3O2/c1-5-8(9(13)14)6(2)12-7(11-5)3-4-10-12/h3-4H,1-2H3,(H,13,14) InChIKey: CDQDQBOILOQEQG-UHFFFAOYSA-N
CBID:244459 http://www.chembase.cn/molecule-244459.html