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SMILES: COC1C=CC=NC1=O Canonical SMILES: COC1C=CC=NC1=O InChI: InChI=1S/C6H7NO2/c1-9-5-3-2-4-7-6(5)8/h2-5H,1H3 InChIKey: JFBATLMFYNXHGA-UHFFFAOYSA-N
CBID:302042 http://www.chembase.cn/molecule-302042.html