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

Systemtic Name: 2-[4-(6-hexoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoic acid Openeye Name: 2-[4-(5-hexoxy-1,1-dimethyl-5-oxo-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoic acid CAS Name: 2-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoic acid IUPAC Name: 2-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoic acid Traditional Name: 2-[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(CCC(C)C)C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H42O6/c1-6-7-8-9-15-32-24(29)11-10-14-26(4,5)21-17-22(27)20(16-23(21)28)19(25(30)31)13-12-18(2)3/h16-19,27-28H,6-15H2,1-5H3,(H,30,31)