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SMILES: n12c(ccn2)[nH]ccc1=O Canonical SMILES: O=c1cc[nH]c2n1ncc2 InChI: InChI=1S/C6H5N3O/c10-6-2-3-7-5-1-4-8-9(5)6/h1-4,7H InChIKey: NOSYRIKBTPXMRH-UHFFFAOYSA-N
CBID:50830 http://www.chembase.cn/molecule-50830.html