6-heptan-4-yl-2-oxidanyl-3-(1-phenylprop-2-enyl)pyran-4-one

Systemtic Name: 6-heptan-4-yl-2-oxidanyl-3-(1-phenylprop-2-enyl)pyran-4-one Openeye Name: 2-hydroxy-3-(1-phenylallyl)-6-(1-propylbutyl)pyran-4-one CAS Name: 6-heptan-4-yl-2-hydroxy-3-(1-phenylprop-2-enyl)-4-pyranone IUPAC Name: 6-heptan-4-yl-2-hydroxy-3-(1-phenylprop-2-enyl)pyran-4-one Traditional Name: 2-hydroxy-3-(1-phenylallyl)-6-(1-propylbutyl)pyran-4-one Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1=CC(=O)C(=C(O1)O)C(C=C)C2=CC=CC=C2

Isomeric SMILES

CCCC(CCC)C1=CC(=O)C(=C(O1)O)C(C=C)C2=CC=CC=C2

InChI

InChI=1S/C21H26O3/c1-4-10-16(11-5-2)19-14-18(22)20(21(23)24-19)17(6-3)15-12-8-7-9-13-15/h6-9,12-14,16-17,23H,3-5,10-11H2,1-2H3