4-hexoxy-5,6,6-tris(oxidanyl)-3-(4-propan-2-ylphenyl)-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 4-hexoxy-5,6,6-tris(oxidanyl)-3-(4-propan-2-ylphenyl)-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 4-hexoxy-5,6,6-trihydroxy-3-(4-isopropylphenyl)-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 4-hexoxy-5,6,6-trihydroxy-3-(4-propan-2-ylphenyl)-5-propyl-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 4-hexoxy-5,6,6-trihydroxy-3-(4-propan-2-ylphenyl)-5-propylcyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 4-hexoxy-5,6,6-trihydroxy-3-p-cumenyl-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid Formula: C25H36O6 MolecularWeight: 432.54974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C(C1(CCC)O)(O)O)C(=O)O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C(C1(CCC)O)(O)O)C(=O)O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C25H36O6/c1-5-7-8-9-15-31-22-20(19-12-10-18(11-13-19)17(3)4)16-21(23(26)27)25(29,30)24(22,28)14-6-2/h10-13,16-17,28-30H,5-9,14-15H2,1-4H3,(H,26,27)