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SMILES: COC(=O)[C@@H]1CC/C(=C(/C#N)\C2=N[C@@H](CC2)C(=O)OC)/N1 Canonical SMILES: COC(=O)[C@@H]1CC/C(=C(\C2=N[C@@H](CC2)C(=O)OC)/C#N)/N1 InChI: InChI=1S/C14H17N3O4/c1-20-13(18)11-5-3-9(16-11)8(7-15)10-4-6-12(17-10)14(19)21-2/h11-12,16H,3-6H2,1-2H3/t11-,12-/m0/s1 InChIKey: HEMMGWQVSFWCAQ-RYUDHWBXSA-N
CBID:156633 http://www.chembase.cn/molecule-156633.html