8-[2-[(E)-4-ethenyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]octyl ethanoate

Systemtic Name: 8-[2-[(E)-4-ethenyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]octyl ethanoate Openeye Name: 8-[3-hydroxy-2-[(E)-4-hydroxy-4-vinyl-oct-1-enyl]-5-oxo-cyclopentyl]octyl acetate CAS Name: acetic acid 8-[2-[(E)-4-ethenyl-4-hydroxyoct-1-enyl]-3-hydroxy-5-oxocyclopentyl]octyl ester IUPAC Name: 8-[2-[(E)-4-ethenyl-4-hydroxyoct-1-enyl]-3-hydroxy-5-oxocyclopentyl]octyl acetate Traditional Name: acetic acid 8-[2-[(1E)-4-butyl-4-hydroxy-hexa-1,5-dienyl]-3-hydroxy-5-keto-cyclopentyl]octyl ester Formula: C25H42O5 MolecularWeight: 422.59798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC=CC1C(CC(=O)C1CCCCCCCCOC(=O)C)O)(C=C)O

Isomeric SMILES

CCCCC(C/C=C/C1C(CC(=O)C1CCCCCCCCOC(=O)C)O)(C=C)O

InChI

InChI=1S/C25H42O5/c1-4-6-16-25(29,5-2)17-13-15-22-21(23(27)19-24(22)28)14-11-9-7-8-10-12-18-30-20(3)26/h5,13,15,21-22,24,28-29H,2,4,6-12,14,16-19H2,1,3H3/b15-13+