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SMILES: c1c(nc(nc1)C#C)C(=O)OC Canonical SMILES: COC(=O)c1ccnc(n1)C#C InChI: InChI=1S/C8H6N2O2/c1-3-7-9-5-4-6(10-7)8(11)12-2/h1,4-5H,2H3 InChIKey: PBCPJTOXAQVNSW-UHFFFAOYSA-N
CBID:814019 http://www.chembase.cn/molecule-814019.html