6-methyl-2-oxidanyl-3-(3-oxidanylidene-1-phenyl-butyl)pyran-4-one

Systemtic Name: 6-methyl-2-oxidanyl-3-(3-oxidanylidene-1-phenyl-butyl)pyran-4-one Openeye Name: 2-hydroxy-6-methyl-3-(3-oxo-1-phenyl-butyl)pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-(3-oxo-1-phenylbutyl)-4-pyranone IUPAC Name: 2-hydroxy-6-methyl-3-(3-oxo-1-phenylbutyl)pyran-4-one Traditional Name: 2-hydroxy-3-(3-keto-1-phenyl-butyl)-6-methyl-pyran-4-one Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(CC(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(CC(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C16H16O4/c1-10(17)8-13(12-6-4-3-5-7-12)15-14(18)9-11(2)20-16(15)19/h3-7,9,13,19H,8H2,1-2H3