7-[4-[2-methyl-4-(3-methylbutanoyl)-3-oxidanyl-phenoxy]butoxy]-2,3-dihydrochromen-4-one

Systemtic Name: 7-[4-[2-methyl-4-(3-methylbutanoyl)-3-oxidanyl-phenoxy]butoxy]-2,3-dihydrochromen-4-one Openeye Name: 7-[4-[3-hydroxy-2-methyl-4-(3-methylbutanoyl)phenoxy]butoxy]chroman-4-one CAS Name: 7-[4-[3-hydroxy-2-methyl-4-(3-methyl-1-oxobutyl)phenoxy]butoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 7-[4-[3-hydroxy-2-methyl-4-(3-methylbutanoyl)phenoxy]butoxy]-2,3-dihydrochromen-4-one Traditional Name: 7-[4-(3-hydroxy-4-isovaleryl-2-methyl-phenoxy)butoxy]chroman-4-one Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCOC2=CC3=C(C=C2)C(=O)CCO3

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)CC(C)C)OCCCCOC2=CC3=C(C=C2)C(=O)CCO3

InChI

InChI=1S/C25H30O6/c1-16(2)14-22(27)20-8-9-23(17(3)25(20)28)30-12-5-4-11-29-18-6-7-19-21(26)10-13-31-24(19)15-18/h6-9,15-16,28H,4-5,10-14H2,1-3H3