4-[6-(3,4-dimethoxy-2,5-dimethyl-phenyl)-6-oxidanylidene-hexoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[6-(3,4-dimethoxy-2,5-dimethyl-phenyl)-6-oxidanylidene-hexoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[6-(3,4-dimethoxy-2,5-dimethyl-phenyl)-6-oxo-hexoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[6-(3,4-dimethoxy-2,5-dimethylphenyl)-6-oxohexoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[6-(3,4-dimethoxy-2,5-dimethylphenyl)-6-oxohexoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[6-(3,4-dimethoxy-2,5-dimethyl-phenyl)-6-keto-hexoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C26H34O7 MolecularWeight: 458.54396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCCC(=O)C2=CC(=C(C(=C2C)OC)OC)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCCC(=O)C2=CC(=C(C(=C2C)OC)OC)C

InChI

InChI=1S/C26H34O7/c1-6-10-18-22(13-12-19(23(18)28)26(29)30)33-14-9-7-8-11-21(27)20-15-16(2)24(31-4)25(32-5)17(20)3/h12-13,15,28H,6-11,14H2,1-5H3,(H,29,30)