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SMILES: c1(cnc(c(c1)C#N)OC)C Canonical SMILES: N#Cc1cc(C)cnc1OC InChI: InChI=1S/C8H8N2O/c1-6-3-7(4-9)8(11-2)10-5-6/h3,5H,1-2H3 InChIKey: CZKDMJBSPOUACB-UHFFFAOYSA-N
CBID:50589 http://www.chembase.cn/molecule-50589.html