ethyl 4-(5,5-dimethyl-2-oxidanylidene-furan-3-yl)-2-methyl-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: ethyl 4-(5,5-dimethyl-2-oxidanylidene-furan-3-yl)-2-methyl-cyclohexa-1,3-diene-1-carboxylate Openeye Name: ethyl 4-(5,5-dimethyl-2-oxo-3-furyl)-2-methyl-cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-(5,5-dimethyl-2-oxo-3-furanyl)-2-methyl-1-cyclohexa-1,3-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5,5-dimethyl-2-oxofuran-3-yl)-2-methylcyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-(2-keto-5,5-dimethyl-3-furyl)-2-methyl-cyclohexa-1,3-diene-1-carboxylic acid ethyl ester Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(CC1)C2=CC(OC2=O)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(CC1)C2=CC(OC2=O)(C)C)C

InChI

InChI=1S/C16H20O4/c1-5-19-14(17)12-7-6-11(8-10(12)2)13-9-16(3,4)20-15(13)18/h8-9H,5-7H2,1-4H3