3-[8-[3,4-bis(oxidanyl)phenyl]-8-oxidanylidene-octyl]-6-oxidanyl-4-oxidanylidene-5-propyl-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 3-[8-[3,4-bis(oxidanyl)phenyl]-8-oxidanylidene-octyl]-6-oxidanyl-4-oxidanylidene-5-propyl-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 3-[8-(3,4-dihydroxyphenyl)-8-oxo-octyl]-6-hydroxy-4-oxo-5-propyl-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 3-[8-(3,4-dihydroxyphenyl)-8-oxooctyl]-6-hydroxy-4-oxo-5-propyl-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 3-[8-(3,4-dihydroxyphenyl)-8-oxooctyl]-6-hydroxy-4-oxo-5-propylcyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 3-[8-(3,4-dihydroxyphenyl)-8-keto-octyl]-6-hydroxy-4-keto-5-propyl-cyclohexa-1,5-diene-1-carboxylic acid Formula: C24H30O7 MolecularWeight: 430.4908

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(C1=O)CCCCCCCC(=O)C2=CC(=C(C=C2)O)O)C(=O)O)O

Isomeric SMILES

CCCC1=C(C(=CC(C1=O)CCCCCCCC(=O)C2=CC(=C(C=C2)O)O)C(=O)O)O

InChI

InChI=1S/C24H30O7/c1-2-8-17-22(28)16(13-18(23(17)29)24(30)31)9-6-4-3-5-7-10-19(25)15-11-12-20(26)21(27)14-15/h11-14,16,26-27,29H,2-10H2,1H3,(H,30,31)