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SMILES: n1cc(ccc1)N=C=O Canonical SMILES: O=C=Nc1cccnc1 InChI: InChI=1S/C6H4N2O/c9-5-8-6-2-1-3-7-4-6/h1-4H InChIKey: SHVVSKCXWMEDRW-UHFFFAOYSA-N
CBID:88610 http://www.chembase.cn/molecule-88610.html