2-[5-[5,7-bis(oxidanyl)-4-oxidanylidene-8-propyl-chromen-2-yl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[5-[5,7-bis(oxidanyl)-4-oxidanylidene-8-propyl-chromen-2-yl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[5-(5,7-dihydroxy-4-oxo-8-propyl-chromen-2-yl)-2-methoxy-phenoxy]acetic acid CAS Name: 2-[5-(5,7-dihydroxy-4-oxo-8-propyl-1-benzopyran-2-yl)-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[5-(5,7-dihydroxy-4-oxo-8-propylchromen-2-yl)-2-methoxyphenoxy]acetic acid Traditional Name: 2-[5-(5,7-dihydroxy-4-keto-8-propyl-chromen-2-yl)-2-methoxy-phenoxy]acetic acid Formula: C21H20O8 MolecularWeight: 400.3787

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C2=C1OC(=CC2=O)C3=CC(=C(C=C3)OC)OCC(=O)O)O)O

Isomeric SMILES

CCCC1=C(C=C(C2=C1OC(=CC2=O)C3=CC(=C(C=C3)OC)OCC(=O)O)O)O

InChI

InChI=1S/C21H20O8/c1-3-4-12-13(22)8-14(23)20-15(24)9-17(29-21(12)20)11-5-6-16(27-2)18(7-11)28-10-19(25)26/h5-9,22-23H,3-4,10H2,1-2H3,(H,25,26)