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

Systemtic Name: hexyl 5-methyl-5-[4-(2-methyl-6-oxidanylidene-dodecan-2-yl)-2,5-bis(oxidanyl)phenyl]hexanoate Openeye Name: hexyl 5-[4-(1,1-dimethyl-5-oxo-undecyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[2,5-dihydroxy-4-(2-methyl-6-oxododecan-2-yl)phenyl]-5-methylhexanoic acid hexyl ester IUPAC Name: hexyl 5-[2,5-dihydroxy-4-(2-methyl-6-oxododecan-2-yl)phenyl]-5-methylhexanoate Traditional Name: 5-[2,5-dihydroxy-4-(5-keto-1,1-dimethyl-undecyl)phenyl]-5-methyl-hexanoic acid hexyl ester Formula: C32H54O5 MolecularWeight: 518.76816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCCC(=O)OCCCCCC)O

Isomeric SMILES

CCCCCCC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCCC(=O)OCCCCCC)O

InChI

InChI=1S/C32H54O5/c1-7-9-11-13-17-25(33)18-15-20-31(3,4)26-23-29(35)27(24-28(26)34)32(5,6)21-16-19-30(36)37-22-14-12-10-8-2/h23-24,34-35H,7-22H2,1-6H3