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

Systemtic Name: 3-[2-[7-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]heptoxy]phenyl]propanoic acid Openeye Name: 3-[2-[7-(4-oxo-8-propyl-chroman-7-yl)oxyheptoxy]phenyl]propanoic acid CAS Name: 3-[2-[7-[(4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]heptoxy]phenyl]propanoic acid IUPAC Name: 3-[2-[7-[(4-oxo-8-propyl-2,3-dihydrochromen-7-yl)oxy]heptoxy]phenyl]propanoic acid Traditional Name: 3-[2-[7-(4-keto-8-propyl-chroman-7-yl)oxyheptoxy]phenyl]propionic acid Formula: C28H36O6 MolecularWeight: 468.58184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCCCCOC3=CC=CC=C3CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCCCCOC3=CC=CC=C3CCC(=O)O

InChI

InChI=1S/C28H36O6/c1-2-10-23-26(15-14-22-24(29)17-20-34-28(22)23)33-19-9-5-3-4-8-18-32-25-12-7-6-11-21(25)13-16-27(30)31/h6-7,11-12,14-15H,2-5,8-10,13,16-20H2,1H3,(H,30,31)