3-[2-[4-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]butoxy]phenyl]propanoic acid

Systemtic Name: 3-[2-[4-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]butoxy]phenyl]propanoic acid Openeye Name: 3-[2-[4-(4-oxo-8-propyl-chroman-7-yl)oxybutoxy]phenyl]propanoic acid CAS Name: 3-[2-[4-[(4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]butoxy]phenyl]propanoic acid IUPAC Name: 3-[2-[4-[(4-oxo-8-propyl-2,3-dihydrochromen-7-yl)oxy]butoxy]phenyl]propanoic acid Traditional Name: 3-[2-[4-(4-keto-8-propyl-chroman-7-yl)oxybutoxy]phenyl]propionic acid Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCOC3=CC=CC=C3CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCOC3=CC=CC=C3CCC(=O)O

InChI

InChI=1S/C25H30O6/c1-2-7-20-23(12-11-19-21(26)14-17-31-25(19)20)30-16-6-5-15-29-22-9-4-3-8-18(22)10-13-24(27)28/h3-4,8-9,11-12H,2,5-7,10,13-17H2,1H3,(H,27,28)