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SMILES: C12(CC3(CC(C1)CC(C2)C3)C(=O)O)n1cncn1 Canonical SMILES: OC(=O)C12CC3CC(C1)CC(C2)(C3)n1cncn1 InChI: InChI=1S/C13H17N3O2/c17-11(18)12-2-9-1-10(3-12)5-13(4-9,6-12)16-8-14-7-15-16/h7-10H,1-6H2,(H,17,18) InChIKey: NTUMBFHGMUZUBG-UHFFFAOYSA-N
CBID:17555 http://www.chembase.cn/molecule-17555.html