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SMILES: N(C(=O)CC#N)c1ncccc1 Canonical SMILES: N#CCC(=O)Nc1ccccn1 InChI: InChI=1S/C8H7N3O/c9-5-4-8(12)11-7-3-1-2-6-10-7/h1-3,6H,4H2,(H,10,11,12) InChIKey: PMEKHNOMXFPLAK-UHFFFAOYSA-N
CBID:231079 http://www.chembase.cn/molecule-231079.html