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SMILES: n1c(n[nH]c1C(=O)OC)Br Canonical SMILES: COC(=O)c1nc(n[nH]1)Br InChI: InChI=1S/C4H4BrN3O2/c1-10-3(9)2-6-4(5)8-7-2/h1H3,(H,6,7,8) InChIKey: GRIBRWPXKUMRDX-UHFFFAOYSA-N
CBID:57838 http://www.chembase.cn/molecule-57838.html