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SMILES: n1(c(=O)n(c2c(c1=O)n(cn2)C)C)CCCBr Canonical SMILES: BrCCCn1c(=O)c2n(C)cnc2n(c1=O)C InChI: InChI=1S/C10H13BrN4O2/c1-13-6-12-8-7(13)9(16)15(5-3-4-11)10(17)14(8)2/h6H,3-5H2,1-2H3 InChIKey: GCEJJEYAPRULFS-UHFFFAOYSA-N
CBID:163048 http://www.chembase.cn/molecule-163048.html