5-[6-[2,3-bis(oxidanyl)-4-propan-2-yl-phenyl]hexoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[6-[2,3-bis(oxidanyl)-4-propan-2-yl-phenyl]hexoxy]-2-oxidanyl-benzoic acid Openeye Name: 5-[6-(2,3-dihydroxy-4-isopropyl-phenyl)hexoxy]-2-hydroxy-benzoic acid CAS Name: 5-[6-(2,3-dihydroxy-4-propan-2-ylphenyl)hexoxy]-2-hydroxybenzoic acid IUPAC Name: 5-[6-(2,3-dihydroxy-4-propan-2-ylphenyl)hexoxy]-2-hydroxybenzoic acid Traditional Name: 5-[6-(2,3-dihydroxy-4-isopropyl-phenyl)hexoxy]-2-hydroxy-benzoic acid Formula: C22H28O6 MolecularWeight: 388.45412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)CCCCCCOC2=CC(=C(C=C2)O)C(=O)O)O)O

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)CCCCCCOC2=CC(=C(C=C2)O)C(=O)O)O)O

InChI

InChI=1S/C22H28O6/c1-14(2)17-10-8-15(20(24)21(17)25)7-5-3-4-6-12-28-16-9-11-19(23)18(13-16)22(26)27/h8-11,13-14,23-25H,3-7,12H2,1-2H3,(H,26,27)