[4-[(E)-4-fluoranyl-3-(phenylcarbonyloxy)oct-1-enyl]-2-oxidanylidene-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate

Systemtic Name: [4-[(E)-4-fluoranyl-3-(phenylcarbonyloxy)oct-1-enyl]-2-oxidanylidene-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate Openeye Name: [4-[(E)-3-benzoyloxy-4-fluoro-oct-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate CAS Name: benzoic acid [4-[(E)-3-benzoyloxy-4-fluorooct-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] ester IUPAC Name: [4-[(E)-3-benzoyloxy-4-fluorooct-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate Traditional Name: benzoic acid [4-[(E)-3-benzoyloxy-4-fluoro-oct-1-enyl]-2-keto-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] ester Formula: C29H31FO6 MolecularWeight: 494.551243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C=CC1C(CC2C1CC(=O)O2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)F

Isomeric SMILES

CCCCC(C(/C=C/C1C(CC2C1CC(=O)O2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C29H31FO6/c1-2-3-14-23(30)24(35-28(32)19-10-6-4-7-11-19)16-15-21-22-17-27(31)34-26(22)18-25(21)36-29(33)20-12-8-5-9-13-20/h4-13,15-16,21-26H,2-3,14,17-18H2,1H3/b16-15+