5-[1,1-bis(oxidanylidene)-3,6-dihydro-2H-thiopyran-5-yl]-2-butanoyl-cyclohexane-1,3-dione

Systemtic Name: 5-[1,1-bis(oxidanylidene)-3,6-dihydro-2H-thiopyran-5-yl]-2-butanoyl-cyclohexane-1,3-dione Openeye Name: 2-butanoyl-5-(1,1-dioxo-3,6-dihydro-2H-thiopyran-5-yl)cyclohexane-1,3-dione CAS Name: 5-(1,1-dioxo-3,6-dihydro-2H-thiopyran-5-yl)-2-(1-oxobutyl)cyclohexane-1,3-dione IUPAC Name: 2-butanoyl-5-(1,1-dioxo-3,6-dihydro-2H-thiopyran-5-yl)cyclohexane-1,3-dione Traditional Name: 2-butyryl-5-(1,1-diketo-3,6-dihydro-2H-thiopyran-5-yl)cyclohexane-1,3-quinone Formula: C15H20O5S MolecularWeight: 312.3813

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(CC1=O)C2=CCCS(=O)(=O)C2

Isomeric SMILES

CCCC(=O)C1C(=O)CC(CC1=O)C2=CCCS(=O)(=O)C2

InChI

InChI=1S/C15H20O5S/c1-2-4-12(16)15-13(17)7-11(8-14(15)18)10-5-3-6-21(19,20)9-10/h5,11,15H,2-4,6-9H2,1H3