(E)-7-cyclopentyl-2-[(E)-4-(3-fluoranylphenoxy)-3,3-bis(oxidanyl)but-1-enyl]hept-5-enoic acid

Systemtic Name: (E)-7-cyclopentyl-2-[(E)-4-(3-fluoranylphenoxy)-3,3-bis(oxidanyl)but-1-enyl]hept-5-enoic acid Openeye Name: (E)-7-cyclopentyl-2-[(E)-4-(3-fluorophenoxy)-3,3-dihydroxy-but-1-enyl]hept-5-enoic acid CAS Name: (E)-7-cyclopentyl-2-[(E)-4-(3-fluorophenoxy)-3,3-dihydroxybut-1-enyl]-5-heptenoic acid IUPAC Name: (E)-7-cyclopentyl-2-[(E)-4-(3-fluorophenoxy)-3,3-dihydroxybut-1-enyl]hept-5-enoic acid Traditional Name: (E)-7-cyclopentyl-2-[(E)-4-(3-fluorophenoxy)-3,3-dihydroxy-but-1-enyl]hept-5-enoic acid Formula: C22H29FO5 MolecularWeight: 392.461063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC=CCCC(C=CC(COC2=CC(=CC=C2)F)(O)O)C(=O)O

Isomeric SMILES

C1CCC(C1)C/C=C/CCC(/C=C/C(COC2=CC(=CC=C2)F)(O)O)C(=O)O

InChI

InChI=1S/C22H29FO5/c23-19-11-6-12-20(15-19)28-16-22(26,27)14-13-18(21(24)25)10-3-1-2-7-17-8-4-5-9-17/h1-2,6,11-15,17-18,26-27H,3-5,7-10,16H2,(H,24,25)/b2-1+,14-13+