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SMILES: c1(c(c(on1)C)COC)C(=O)O Canonical SMILES: COCc1c(C)onc1C(=O)O InChI: InChI=1S/C7H9NO4/c1-4-5(3-11-2)6(7(9)10)8-12-4/h3H2,1-2H3,(H,9,10) InChIKey: CRBKTECADDKUPY-UHFFFAOYSA-N
CBID:33768 http://www.chembase.cn/molecule-33768.html