3-methyl-1-[6-(3-methylbutanoyl)-1,3,7,9-tetrakis(oxidanyl)dibenzofuran-2-yl]butan-1-one

Systemtic Name: 3-methyl-1-[6-(3-methylbutanoyl)-1,3,7,9-tetrakis(oxidanyl)dibenzofuran-2-yl]butan-1-one Openeye Name: 3-methyl-1-[1,3,7,9-tetrahydroxy-6-(3-methylbutanoyl)dibenzofuran-2-yl]butan-1-one CAS Name: 3-methyl-1-[1,3,7,9-tetrahydroxy-6-(3-methyl-1-oxobutyl)-2-dibenzofuranyl]-1-butanone IUPAC Name: 3-methyl-1-[1,3,7,9-tetrahydroxy-6-(3-methylbutanoyl)dibenzofuran-2-yl]butan-1-one Traditional Name: 3-methyl-1-(1,3,7,9-tetrahydroxy-6-isovaleryl-dibenzofuran-2-yl)butan-1-one Formula: C22H24O7 MolecularWeight: 400.42176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=C(C=C(C2=C1OC3=CC(=C(C(=C32)O)C(=O)CC(C)C)O)O)O

Isomeric SMILES

CC(C)CC(=O)C1=C(C=C(C2=C1OC3=CC(=C(C(=C32)O)C(=O)CC(C)C)O)O)O

InChI

InChI=1S/C22H24O7/c1-9(2)5-11(23)17-15(27)8-16-20(21(17)28)19-14(26)7-13(25)18(22(19)29-16)12(24)6-10(3)4/h7-10,25-28H,5-6H2,1-4H3