5-[4-(6-hexoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoic acid

Systemtic Name: 5-[4-(6-hexoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoic acid Openeye Name: 5-[4-(5-hexoxy-1,1-dimethyl-5-oxo-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoic acid CAS Name: 5-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoic acid IUPAC Name: 5-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoic acid Traditional Name: 5-[4-(5-hexoxy-5-keto-1,1-dimethyl-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoic acid Formula: C26H42O6 MolecularWeight: 450.60808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC(C)(C)C1=C(C=C(C(=C1)O)C(C)(C)CCCC(=O)O)O

Isomeric SMILES

CCCCCCOC(=O)CCCC(C)(C)C1=C(C=C(C(=C1)O)C(C)(C)CCCC(=O)O)O

InChI

InChI=1S/C26H42O6/c1-6-7-8-9-16-32-24(31)13-11-15-26(4,5)20-18-21(27)19(17-22(20)28)25(2,3)14-10-12-23(29)30/h17-18,27-28H,6-16H2,1-5H3,(H,29,30)