3-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butyl]-2-methyl-7-oxidanyl-2,3-dihydrochromen-4-one

Systemtic Name: 3-[4-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)butyl]-2-methyl-7-oxidanyl-2,3-dihydrochromen-4-one Openeye Name: 3-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butyl]-7-hydroxy-2-methyl-chroman-4-one CAS Name: 3-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butyl]-7-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3-[4-(4-acetyl-3-hydroxy-2-propylphenoxy)butyl]-7-hydroxy-2-methyl-2,3-dihydrochromen-4-one Traditional Name: 3-[4-(4-acetyl-3-hydroxy-2-propyl-phenoxy)butyl]-7-hydroxy-2-methyl-chroman-4-one Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2C(OC3=C(C2=O)C=CC(=C3)O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2C(OC3=C(C2=O)C=CC(=C3)O)C

InChI

InChI=1S/C25H30O6/c1-4-7-20-22(12-11-18(15(2)26)24(20)28)30-13-6-5-8-19-16(3)31-23-14-17(27)9-10-21(23)25(19)29/h9-12,14,16,19,27-28H,4-8,13H2,1-3H3