ethyl 7-[2-(3-ethyl-3-oxidanyl-oct-1-ynyl)-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[2-(3-ethyl-3-oxidanyl-oct-1-ynyl)-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-(3-ethyl-3-hydroxy-oct-1-ynyl)-3-hydroxy-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[2-(3-ethyl-3-hydroxyoct-1-ynyl)-3-hydroxy-5-oxocyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-(3-ethyl-3-hydroxyoct-1-ynyl)-3-hydroxy-5-oxocyclopentyl]heptanoate Traditional Name: 7-[2-(3-ethyl-3-hydroxy-oct-1-ynyl)-3-hydroxy-5-keto-cyclopentyl]enanthic acid ethyl ester Formula: C24H40O5 MolecularWeight: 408.5714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)(C#CC1C(CC(=O)C1CCCCCCC(=O)OCC)O)O

Isomeric SMILES

CCCCCC(CC)(C#CC1C(CC(=O)C1CCCCCCC(=O)OCC)O)O

InChI

InChI=1S/C24H40O5/c1-4-7-12-16-24(28,5-2)17-15-20-19(21(25)18-22(20)26)13-10-8-9-11-14-23(27)29-6-3/h19-20,22,26,28H,4-14,16,18H2,1-3H3