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SMILES: OC(=O)c1cc(nc(c1)Br)N Canonical SMILES: Nc1nc(Br)cc(c1)C(=O)O InChI: InChI=1S/C6H5BrN2O2/c7-4-1-3(6(10)11)2-5(8)9-4/h1-2H,(H2,8,9)(H,10,11) InChIKey: KAYIMZWPSQTZJI-UHFFFAOYSA-N
CBID:814858 http://www.chembase.cn/molecule-814858.html