4-[8-[3,4-bis(oxidanyl)phenyl]-8-oxidanylidene-octoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[8-[3,4-bis(oxidanyl)phenyl]-8-oxidanylidene-octoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[8-(3,4-dihydroxyphenyl)-8-oxo-octoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[8-(3,4-dihydroxyphenyl)-8-oxooctoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[8-(3,4-dihydroxyphenyl)-8-oxooctoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[8-(3,4-dihydroxyphenyl)-8-keto-octoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C24H30O7 MolecularWeight: 430.4908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30O7/c1-2-8-17-22(13-11-18(23(17)28)24(29)30)31-14-7-5-3-4-6-9-19(25)16-10-12-20(26)21(27)15-16/h10-13,15,26-28H,2-9,14H2,1H3,(H,29,30)