4-[6-[4-tert-butyl-2,3-bis(oxidanyl)phenyl]hexoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[6-[4-tert-butyl-2,3-bis(oxidanyl)phenyl]hexoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[6-(4-tert-butyl-2,3-dihydroxy-phenyl)hexoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[6-(4-tert-butyl-2,3-dihydroxyphenyl)hexoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[6-(4-tert-butyl-2,3-dihydroxyphenyl)hexoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[6-(4-tert-butyl-2,3-dihydroxy-phenyl)hexoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C26H36O6 MolecularWeight: 444.56044

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCCCC2=C(C(=C(C=C2)C(C)(C)C)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCCCC2=C(C(=C(C=C2)C(C)(C)C)O)O

InChI

InChI=1S/C26H36O6/c1-5-10-18-21(15-13-19(23(18)28)25(30)31)32-16-9-7-6-8-11-17-12-14-20(26(2,3)4)24(29)22(17)27/h12-15,27-29H,5-11,16H2,1-4H3,(H,30,31)