hexyl 5-[2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoate

Systemtic Name: hexyl 5-[2,5-bis(oxidanyl)phenyl]-5-methyl-hexanoate Openeye Name: hexyl 5-(2,5-dihydroxyphenyl)-5-methyl-hexanoate CAS Name: 5-(2,5-dihydroxyphenyl)-5-methylhexanoic acid hexyl ester IUPAC Name: hexyl 5-(2,5-dihydroxyphenyl)-5-methylhexanoate Traditional Name: 5-(2,5-dihydroxyphenyl)-5-methyl-hexanoic acid hexyl ester Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O4/c1-4-5-6-7-13-23-18(22)9-8-12-19(2,3)16-14-15(20)10-11-17(16)21/h10-11,14,20-21H,4-9,12-13H2,1-3H3