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

Systemtic Name: hexyl 4-[4-(6-hexoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-2,5-bis(oxidanyl)phenyl]-4-methyl-hexanoate Openeye Name: hexyl 4-[4-(5-hexoxy-1,1-dimethyl-5-oxo-pentyl)-2,5-dihydroxy-phenyl]-4-methyl-hexanoate CAS Name: 4-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-4-methylhexanoic acid hexyl ester IUPAC Name: hexyl 4-[4-(6-hexoxy-2-methyl-6-oxohexan-2-yl)-2,5-dihydroxyphenyl]-4-methylhexanoate Traditional Name: 4-[4-(5-hexoxy-5-keto-1,1-dimethyl-pentyl)-2,5-dihydroxy-phenyl]-4-methyl-hexanoic acid hexyl ester Formula: C32H54O6 MolecularWeight: 534.76756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(CC)CCC(=O)OCCCCCC)O

Isomeric SMILES

CCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(CC)CCC(=O)OCCCCCC)O

InChI

InChI=1S/C32H54O6/c1-7-10-12-14-21-37-29(35)17-16-19-31(4,5)25-23-28(34)26(24-27(25)33)32(6,9-3)20-18-30(36)38-22-15-13-11-8-2/h23-24,33-34H,7-22H2,1-6H3