hexyl 3-[2,5-bis(oxidanyl)phenyl]-3-methyl-butanoate

Systemtic Name: hexyl 3-[2,5-bis(oxidanyl)phenyl]-3-methyl-butanoate Openeye Name: hexyl 3-(2,5-dihydroxyphenyl)-3-methyl-butanoate CAS Name: 3-(2,5-dihydroxyphenyl)-3-methylbutanoic acid hexyl ester IUPAC Name: hexyl 3-(2,5-dihydroxyphenyl)-3-methylbutanoate Traditional Name: 3-(2,5-dihydroxyphenyl)-3-methyl-butyric acid hexyl ester Formula: C17H26O4 MolecularWeight: 294.38594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O4/c1-4-5-6-7-10-21-16(20)12-17(2,3)14-11-13(18)8-9-15(14)19/h8-9,11,18-19H,4-7,10,12H2,1-3H3