6-methyl-2-oxidanyl-3-(4-thiophen-2-ylbutanoyl)pyran-4-one

Systemtic Name: 6-methyl-2-oxidanyl-3-(4-thiophen-2-ylbutanoyl)pyran-4-one Openeye Name: 2-hydroxy-6-methyl-3-[4-(2-thienyl)butanoyl]pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-(1-oxo-4-thiophen-2-ylbutyl)-4-pyranone IUPAC Name: 2-hydroxy-6-methyl-3-(4-thiophen-2-ylbutanoyl)pyran-4-one Traditional Name: 2-hydroxy-6-methyl-3-[4-(2-thienyl)butanoyl]pyran-4-one Formula: C14H14O4S MolecularWeight: 278.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)CCCC2=CC=CS2

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)CCCC2=CC=CS2

InChI

InChI=1S/C14H14O4S/c1-9-8-12(16)13(14(17)18-9)11(15)6-2-4-10-5-3-7-19-10/h3,5,7-8,17H,2,4,6H2,1H3