methyl 3-butanoyl-6-(oxan-4-ylmethyl)-2,4-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl 3-butanoyl-6-(oxan-4-ylmethyl)-2,4-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl 3-butanoyl-2,4-dioxo-6-(tetrahydropyran-4-ylmethyl)cyclohexanecarboxylate CAS Name: 6-(4-oxanylmethyl)-2,4-dioxo-3-(1-oxobutyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-butanoyl-6-(oxan-4-ylmethyl)-2,4-dioxocyclohexane-1-carboxylate Traditional Name: 3-butyryl-2,4-diketo-6-(tetrahydropyran-4-ylmethyl)cyclohexanecarboxylic acid methyl ester Formula: C18H26O6 MolecularWeight: 338.39544

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(C(C1=O)C(=O)OC)CC2CCOCC2

Isomeric SMILES

CCCC(=O)C1C(=O)CC(C(C1=O)C(=O)OC)CC2CCOCC2

InChI

InChI=1S/C18H26O6/c1-3-4-13(19)16-14(20)10-12(9-11-5-7-24-8-6-11)15(17(16)21)18(22)23-2/h11-12,15-16H,3-10H2,1-2H3