7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-2,3-dihydrochromene-2-carboxylic acid

Systemtic Name: 7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-2,3-dihydrochromene-2-carboxylic acid Openeye Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-4-oxo-chromane-2-carboxylic acid CAS Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-oxo-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-oxo-2,3-dihydrochromene-2-carboxylic acid Traditional Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-4-keto-chroman-2-carboxylic acid Formula: C24H26O9 MolecularWeight: 458.45784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=CC3=C(C=C2)C(=O)CC(O3)C(=O)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=CC3=C(C=C2)C(=O)CC(O3)C(=O)O)O

InChI

InChI=1S/C24H26O9/c1-3-4-18-20(8-7-16(13(2)25)23(18)28)32-12-14(26)11-31-15-5-6-17-19(27)10-22(24(29)30)33-21(17)9-15/h5-9,14,22,26,28H,3-4,10-12H2,1-2H3,(H,29,30)