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SMILES: n1(c2ccc(cc2)OC)cccc(c1=O)C#N Canonical SMILES: COc1ccc(cc1)n1cccc(c1=O)C#N InChI: InChI=1S/C13H10N2O2/c1-17-12-6-4-11(5-7-12)15-8-2-3-10(9-14)13(15)16/h2-8H,1H3 InChIKey: BEDGQGYVNVJQLQ-UHFFFAOYSA-N
CBID:92752 http://www.chembase.cn/molecule-92752.html