3-[5-(4-ethoxy-4-oxidanylidene-butoxy)-2-[6-(oxan-2-yloxy)hexyl]phenyl]propanoic acid

Systemtic Name: 3-[5-(4-ethoxy-4-oxidanylidene-butoxy)-2-[6-(oxan-2-yloxy)hexyl]phenyl]propanoic acid Openeye Name: 3-[5-(4-ethoxy-4-oxo-butoxy)-2-(6-tetrahydropyran-2-yloxyhexyl)phenyl]propanoic acid CAS Name: 3-[5-(4-ethoxy-4-oxobutoxy)-2-[6-(2-oxanyloxy)hexyl]phenyl]propanoic acid IUPAC Name: 3-[5-(4-ethoxy-4-oxobutoxy)-2-[6-(oxan-2-yloxy)hexyl]phenyl]propanoic acid Traditional Name: 3-[5-(4-ethoxy-4-keto-butoxy)-2-(6-tetrahydropyran-2-yloxyhexyl)phenyl]propionic acid Formula: C26H40O7 MolecularWeight: 464.5916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC(=C(C=C1)CCCCCCOC2CCCCO2)CCC(=O)O

Isomeric SMILES

CCOC(=O)CCCOC1=CC(=C(C=C1)CCCCCCOC2CCCCO2)CCC(=O)O

InChI

InChI=1S/C26H40O7/c1-2-30-25(29)11-9-19-31-23-15-13-21(22(20-23)14-16-24(27)28)10-5-3-4-7-17-32-26-12-6-8-18-33-26/h13,15,20,26H,2-12,14,16-19H2,1H3,(H,27,28)