8-[6-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)hexoxy]-8-oxidanylidene-octanoate

Systemtic Name: 8-[6-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)hexoxy]-8-oxidanylidene-octanoate Openeye Name: 8-[6-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)hexoxy]-8-oxo-octanoate CAS Name: 8-[6-(3-tert-butyl-4-hydroxy-5-methylphenyl)hexoxy]-8-oxooctanoate IUPAC Name: 8-[6-(3-tert-butyl-4-hydroxy-5-methylphenyl)hexoxy]-8-oxooctanoate Traditional Name: 8-[6-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)hexoxy]-8-keto-caprylate Formula: C25H39O5- MolecularWeight: 419.57416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CCCCCCOC(=O)CCCCCCC(=O)[O-])C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CCCCCCOC(=O)CCCCCCC(=O)[O-])C(C)(C)C)O

InChI

InChI=1S/C25H40O5/c1-19-17-20(18-21(24(19)29)25(2,3)4)13-9-7-8-12-16-30-23(28)15-11-6-5-10-14-22(26)27/h17-18,29H,5-16H2,1-4H3,(H,26,27)/p-1