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SMILES: c1(c(c[nH]n1)C=O)C(C)(C)C Canonical SMILES: O=Cc1c[nH]nc1C(C)(C)C InChI: InChI=1S/C8H12N2O/c1-8(2,3)7-6(5-11)4-9-10-7/h4-5H,1-3H3,(H,9,10) InChIKey: JQCJTNPAWAQSFC-UHFFFAOYSA-N
CBID:17241 http://www.chembase.cn/molecule-17241.html