ethyl 3-[(1R,2R,3S)-3-oxidanyl-5-oxidanylidene-2-[(E)-8-oxidanyloct-1-enyl]cyclopentyl]benzoate

Systemtic Name: ethyl 3-[(1R,2R,3S)-3-oxidanyl-5-oxidanylidene-2-[(E)-8-oxidanyloct-1-enyl]cyclopentyl]benzoate Openeye Name: ethyl 3-[(1R,2R,3S)-3-hydroxy-2-[(E)-8-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]benzoate CAS Name: 3-[(1R,2R,3S)-3-hydroxy-2-[(E)-8-hydroxyoct-1-enyl]-5-oxocyclopentyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(1R,2R,3S)-3-hydroxy-2-[(E)-8-hydroxyoct-1-enyl]-5-oxocyclopentyl]benzoate Traditional Name: 3-[(1R,2R,3S)-3-hydroxy-2-[(E)-8-hydroxyoct-1-enyl]-5-keto-cyclopentyl]benzoic acid ethyl ester Formula: C22H30O5 MolecularWeight: 374.4706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)C2C(C(CC2=O)O)C=CCCCCCCO

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)[C@H]2[C@H]([C@H](CC2=O)O)/C=C/CCCCCCO

InChI

InChI=1S/C22H30O5/c1-2-27-22(26)17-11-9-10-16(14-17)21-18(19(24)15-20(21)25)12-7-5-3-4-6-8-13-23/h7,9-12,14,18-19,21,23-24H,2-6,8,13,15H2,1H3/b12-7+/t18-,19-,21-/m0/s1