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

Systemtic Name: 4-[6-[4-methyl-2,3-bis(oxidanyl)phenyl]hexoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[6-(2,3-dihydroxy-4-methyl-phenyl)hexoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[6-(2,3-dihydroxy-4-methylphenyl)hexoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[6-(2,3-dihydroxy-4-methylphenyl)hexoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[6-(2,3-dihydroxy-4-methyl-phenyl)hexoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C23H30O6 MolecularWeight: 402.4807

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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)O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H30O6/c1-3-8-17-19(13-12-18(22(17)26)23(27)28)29-14-7-5-4-6-9-16-11-10-15(2)20(24)21(16)25/h10-13,24-26H,3-9,14H2,1-2H3,(H,27,28)