ethyl 4,6-dimethyl-1-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-carboxylate

Systemtic Name: ethyl 4,6-dimethyl-1-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-carboxylate Openeye Name: ethyl 1-hydroxy-4,6-dimethyl-3-oxo-1H-isobenzofuran-5-carboxylate CAS Name: 1-hydroxy-4,6-dimethyl-3-oxo-1H-isobenzofuran-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-hydroxy-4,6-dimethyl-3-oxo-1H-2-benzofuran-5-carboxylate Traditional Name: 1-hydroxy-3-keto-4,6-dimethyl-phthalan-5-carboxylic acid ethyl ester Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(OC(=O)C2=C1C)O)C

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(OC(=O)C2=C1C)O)C

InChI

InChI=1S/C13H14O5/c1-4-17-12(15)9-6(2)5-8-10(7(9)3)13(16)18-11(8)14/h5,11,14H,4H2,1-3H3