5-[5-[3-[2-ethyl-4-(4-fluorophenyl)-5-oxidanyl-phenoxy]propoxy]-2-oxidanylidene-3,4-dihydrochromen-8-yl]pentanoic acid

Systemtic Name: 5-[5-[3-[2-ethyl-4-(4-fluorophenyl)-5-oxidanyl-phenoxy]propoxy]-2-oxidanylidene-3,4-dihydrochromen-8-yl]pentanoic acid Openeye Name: 5-[5-[3-[2-ethyl-4-(4-fluorophenyl)-5-hydroxy-phenoxy]propoxy]-2-oxo-chroman-8-yl]pentanoic acid CAS Name: 5-[5-[3-[2-ethyl-4-(4-fluorophenyl)-5-hydroxyphenoxy]propoxy]-2-oxo-3,4-dihydro-2H-1-benzopyran-8-yl]pentanoic acid IUPAC Name: 5-[5-[3-[2-ethyl-4-(4-fluorophenyl)-5-hydroxyphenoxy]propoxy]-2-oxo-3,4-dihydrochromen-8-yl]pentanoic acid Traditional Name: 5-[5-[3-[2-ethyl-4-(4-fluorophenyl)-5-hydroxy-phenoxy]propoxy]-2-keto-chroman-8-yl]valeric acid Formula: C31H33FO7 MolecularWeight: 536.587923

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)O)OCCCOC3=C4CCC(=O)OC4=C(C=C3)CCCCC(=O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)O)OCCCOC3=C4CCC(=O)OC4=C(C=C3)CCCCC(=O)O

InChI

InChI=1S/C31H33FO7/c1-2-20-18-25(21-8-11-23(32)12-9-21)26(33)19-28(20)38-17-5-16-37-27-14-10-22(6-3-4-7-29(34)35)31-24(27)13-15-30(36)39-31/h8-12,14,18-19,33H,2-7,13,15-17H2,1H3,(H,34,35)