3-[7-[3-(4-methoxy-3-oxidanyl-2-propyl-phenoxy)propoxy]-4-oxidanylidene-8-propyl-chromen-2-yl]propanoic acid

Systemtic Name: 3-[7-[3-(4-methoxy-3-oxidanyl-2-propyl-phenoxy)propoxy]-4-oxidanylidene-8-propyl-chromen-2-yl]propanoic acid Openeye Name: 3-[7-[3-(3-hydroxy-4-methoxy-2-propyl-phenoxy)propoxy]-4-oxo-8-propyl-chromen-2-yl]propanoic acid CAS Name: 3-[7-[3-(3-hydroxy-4-methoxy-2-propylphenoxy)propoxy]-4-oxo-8-propyl-1-benzopyran-2-yl]propanoic acid IUPAC Name: 3-[7-[3-(3-hydroxy-4-methoxy-2-propylphenoxy)propoxy]-4-oxo-8-propylchromen-2-yl]propanoic acid Traditional Name: 3-[7-[3-(3-hydroxy-4-methoxy-2-propyl-phenoxy)propoxy]-4-keto-8-propyl-chromen-2-yl]propionic acid Formula: C28H34O8 MolecularWeight: 498.56476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)OC)OCCCOC2=C(C3=C(C=C2)C(=O)C=C(O3)CCC(=O)O)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)OC)OCCCOC2=C(C3=C(C=C2)C(=O)C=C(O3)CCC(=O)O)CCC

InChI

InChI=1S/C28H34O8/c1-4-7-20-23(12-13-25(33-3)27(20)32)34-15-6-16-35-24-11-10-19-22(29)17-18(9-14-26(30)31)36-28(19)21(24)8-5-2/h10-13,17,32H,4-9,14-16H2,1-3H3,(H,30,31)