ethyl 6,6-dimethyl-3-oxidanyl-4-oxidanylidene-5,7-dihydro-2H-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6,6-dimethyl-3-oxidanyl-4-oxidanylidene-5,7-dihydro-2H-1-benzofuran-3-carboxylate Openeye Name: ethyl 3-hydroxy-6,6-dimethyl-4-oxo-5,7-dihydro-2H-benzofuran-3-carboxylate CAS Name: 3-hydroxy-6,6-dimethyl-4-oxo-5,7-dihydro-2H-benzofuran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-6,6-dimethyl-4-oxo-5,7-dihydro-2H-1-benzofuran-3-carboxylate Traditional Name: 3-hydroxy-4-keto-6,6-dimethyl-5,7-dihydro-2H-benzofuran-3-carboxylic acid ethyl ester Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(COC2=C1C(=O)CC(C2)(C)C)O

Isomeric SMILES

CCOC(=O)C1(COC2=C1C(=O)CC(C2)(C)C)O

InChI

InChI=1S/C13H18O5/c1-4-17-11(15)13(16)7-18-9-6-12(2,3)5-8(14)10(9)13/h16H,4-7H2,1-3H3