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SMILES: n1c(c(cc(c1)Br)[N+](=O)[O-])NCC Canonical SMILES: CCNc1ncc(cc1[N+](=O)[O-])Br InChI: InChI=1S/C7H8BrN3O2/c1-2-9-7-6(11(12)13)3-5(8)4-10-7/h3-4H,2H2,1H3,(H,9,10) InChIKey: XQDUACRLXPWNLD-UHFFFAOYSA-N
CBID:90147 http://www.chembase.cn/molecule-90147.html