ethyl 2,4-bis(oxidanylidene)-4-(2-oxidanyl-3-oxidanylidene-cyclohepta-1,4,6-trien-1-yl)butanoate

Systemtic Name: ethyl 2,4-bis(oxidanylidene)-4-(2-oxidanyl-3-oxidanylidene-cyclohepta-1,4,6-trien-1-yl)butanoate Openeye Name: ethyl 4-(2-hydroxy-3-oxo-cyclohepta-1,4,6-trien-1-yl)-2,4-dioxo-butanoate CAS Name: 4-(2-hydroxy-3-oxo-1-cyclohepta-1,4,6-trienyl)-2,4-dioxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(2-hydroxy-3-oxocyclohepta-1,4,6-trien-1-yl)-2,4-dioxobutanoate Traditional Name: 4-(2-hydroxy-3-keto-cyclohepta-1,4,6-trien-1-yl)-2,4-diketo-butyric acid ethyl ester Formula: C13H12O6 MolecularWeight: 264.23078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CC(=O)C1=C(C(=O)C=CC=C1)O

Isomeric SMILES

CCOC(=O)C(=O)CC(=O)C1=C(C(=O)C=CC=C1)O

InChI

InChI=1S/C13H12O6/c1-2-19-13(18)11(16)7-10(15)8-5-3-4-6-9(14)12(8)17/h3-6H,2,7H2,1H3,(H,14,17)