ethyl 4,4,6-trimethyl-1,3-bis(oxidanylidene)-7,7a-dihydro-3aH-2-benzofuran-5-carboxylate

Systemtic Name: ethyl 4,4,6-trimethyl-1,3-bis(oxidanylidene)-7,7a-dihydro-3aH-2-benzofuran-5-carboxylate Openeye Name: ethyl 4,4,6-trimethyl-1,3-dioxo-7,7a-dihydro-3aH-isobenzofuran-5-carboxylate CAS Name: 4,4,6-trimethyl-1,3-dioxo-7,7a-dihydro-3aH-isobenzofuran-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4,4,6-trimethyl-1,3-dioxo-7,7a-dihydro-3aH-2-benzofuran-5-carboxylate Traditional Name: 1,3-diketo-4,4,6-trimethyl-7,7a-dihydro-3aH-isobenzofuran-5-carboxylic acid ethyl ester Formula: C14H18O5 MolecularWeight: 266.28972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(CC2C(C1(C)C)C(=O)OC2=O)C

Isomeric SMILES

CCOC(=O)C1=C(CC2C(C1(C)C)C(=O)OC2=O)C

InChI

InChI=1S/C14H18O5/c1-5-18-12(16)9-7(2)6-8-10(14(9,3)4)13(17)19-11(8)15/h8,10H,5-6H2,1-4H3