ethyl (E)-7-[3-oxidanyl-5-oxidanylidene-2-[(E)-3-oxidanyl-2-phenyl-oct-1-enyl]cyclopentyl]hept-5-enoate

Systemtic Name: ethyl (E)-7-[3-oxidanyl-5-oxidanylidene-2-[(E)-3-oxidanyl-2-phenyl-oct-1-enyl]cyclopentyl]hept-5-enoate Openeye Name: ethyl (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoate CAS Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyloct-1-enyl]-5-oxocyclopentyl]-5-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoate Traditional Name: (E)-7-[3-hydroxy-2-[(E)-3-hydroxy-2-phenyl-oct-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid ethyl ester Formula: C28H40O5 MolecularWeight: 456.6142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=CC1C(CC(=O)C1CC=CCCCC(=O)OCC)O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCC(/C(=C/C1C(CC(=O)C1C/C=C/CCCC(=O)OCC)O)/C2=CC=CC=C2)O

InChI

InChI=1S/C28H40O5/c1-3-5-9-17-25(29)23(21-14-10-8-11-15-21)19-24-22(26(30)20-27(24)31)16-12-6-7-13-18-28(32)33-4-2/h6,8,10-12,14-15,19,22,24-25,27,29,31H,3-5,7,9,13,16-18,20H2,1-2H3/b12-6+,23-19+