3-[2-[5-[(3-oxidanylidene-7-propyl-1-benzofuran-6-yl)oxy]pentoxy]phenyl]propanoic acid

Systemtic Name: 3-[2-[5-[(3-oxidanylidene-7-propyl-1-benzofuran-6-yl)oxy]pentoxy]phenyl]propanoic acid Openeye Name: 3-[2-[5-(3-oxo-7-propyl-benzofuran-6-yl)oxypentoxy]phenyl]propanoic acid CAS Name: 3-[2-[5-[(3-oxo-7-propyl-6-benzofuranyl)oxy]pentoxy]phenyl]propanoic acid IUPAC Name: 3-[2-[5-[(3-oxo-7-propyl-1-benzofuran-6-yl)oxy]pentoxy]phenyl]propanoic acid Traditional Name: 3-[2-[5-(3-keto-7-propyl-coumaran-6-yl)oxypentoxy]phenyl]propionic acid Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCC2=O)OCCCCCOC3=CC=CC=C3CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1OCC2=O)OCCCCCOC3=CC=CC=C3CCC(=O)O

InChI

InChI=1S/C25H30O6/c1-2-8-20-23(13-12-19-21(26)17-31-25(19)20)30-16-7-3-6-15-29-22-10-5-4-9-18(22)11-14-24(27)28/h4-5,9-10,12-13H,2-3,6-8,11,14-17H2,1H3,(H,27,28)