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

Systemtic Name: methyl 5-[4-(6-hexoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoate Openeye Name: methyl 5-[4-(5-hexoxy-1,1-dimethyl-5-oxo-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-5-methylhexanoate Traditional Name: 5-[4-(5-hexoxy-5-keto-1,1-dimethyl-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoic acid methyl ester Formula: C27H44O6 MolecularWeight: 464.63466

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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)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C27H44O6/c1-7-8-9-10-17-33-25(31)14-12-16-27(4,5)21-19-22(28)20(18-23(21)29)26(2,3)15-11-13-24(30)32-6/h18-19,28-29H,7-17H2,1-6H3