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SMILES: C(=O)(c1ccnc(c1)C#N)O Canonical SMILES: N#Cc1nccc(c1)C(=O)O InChI: InChI=1S/C7H4N2O2/c8-4-6-3-5(7(10)11)1-2-9-6/h1-3H,(H,10,11) InChIKey: MPSVJNPESHZCIB-UHFFFAOYSA-N
CBID:68124 http://www.chembase.cn/molecule-68124.html