7-[2-[(E)-4-ethynyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptyl ethanoate

Systemtic Name: 7-[2-[(E)-4-ethynyl-4-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptyl ethanoate Openeye Name: 7-[2-[(E)-4-ethynyl-4-hydroxy-oct-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]heptyl acetate CAS Name: acetic acid 7-[2-[(E)-4-ethynyl-4-hydroxyoct-1-enyl]-3-hydroxy-5-oxocyclopentyl]heptyl ester IUPAC Name: 7-[2-[(E)-4-ethynyl-4-hydroxyoct-1-enyl]-3-hydroxy-5-oxocyclopentyl]heptyl acetate Traditional Name: acetic acid 7-[2-[(E)-4-butyl-4-hydroxy-hex-1-en-5-ynyl]-3-hydroxy-5-keto-cyclopentyl]heptyl ester Formula: C24H38O5 MolecularWeight: 406.55552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC=CC1C(CC(=O)C1CCCCCCCOC(=O)C)O)(C#C)O

Isomeric SMILES

CCCCC(C/C=C/C1C(CC(=O)C1CCCCCCCOC(=O)C)O)(C#C)O

InChI

InChI=1S/C24H38O5/c1-4-6-15-24(28,5-2)16-12-14-21-20(22(26)18-23(21)27)13-10-8-7-9-11-17-29-19(3)25/h2,12,14,20-21,23,27-28H,4,6-11,13,15-18H2,1,3H3/b14-12+