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SMILES: C1(=NCC(O1)c1ccc(cc1)Br)N Canonical SMILES: NC1=NCC(O1)c1ccc(cc1)Br InChI: InChI=1S/C9H9BrN2O/c10-7-3-1-6(2-4-7)8-5-12-9(11)13-8/h1-4,8H,5H2,(H2,11,12) InChIKey: QKNWNIQGFNMGFH-UHFFFAOYSA-N
CBID:54621 http://www.chembase.cn/molecule-54621.html