2-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]ethanoic acid

Systemtic Name: 2-[7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]ethanoic acid Openeye Name: 2-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-4-methyl-2-oxo-chromen-3-yl]acetic acid CAS Name: 2-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-methyl-2-oxo-1-benzopyran-3-yl]acetic acid IUPAC Name: 2-[7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-methyl-2-oxochromen-3-yl]acetic acid Traditional Name: 2-[7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-keto-4-methyl-chromen-3-yl]acetic acid Formula: C26H28O9 MolecularWeight: 484.49512

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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(=C(C(=O)O3)CC(=O)O)C)O

Isomeric SMILES

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

InChI

InChI=1S/C26H28O9/c1-4-5-20-22(9-8-19(15(3)27)25(20)31)34-13-16(28)12-33-17-6-7-18-14(2)21(11-24(29)30)26(32)35-23(18)10-17/h6-10,16,28,31H,4-5,11-13H2,1-3H3,(H,29,30)