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SMILES: COC(=O)c1c2[nH]ncc2ccc1N Canonical SMILES: COC(=O)c1c(N)ccc2c1[nH]nc2 InChI: InChI=1S/C9H9N3O2/c1-14-9(13)7-6(10)3-2-5-4-11-12-8(5)7/h2-4H,10H2,1H3,(H,11,12) InChIKey: QHEAFURFKCHXJW-UHFFFAOYSA-N
CBID:293000 http://www.chembase.cn/molecule-293000.html