methyl 7-[3-acetyloxy-5-oxidanylidene-2-(3-oxidanyloct-1-ynyl)cyclopentyl]heptanoate

Systemtic Name: methyl 7-[3-acetyloxy-5-oxidanylidene-2-(3-oxidanyloct-1-ynyl)cyclopentyl]heptanoate Openeye Name: methyl 7-[3-acetoxy-2-(3-hydroxyoct-1-ynyl)-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[3-acetyloxy-2-(3-hydroxyoct-1-ynyl)-5-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[3-acetyloxy-2-(3-hydroxyoct-1-ynyl)-5-oxocyclopentyl]heptanoate Traditional Name: 7-[3-acetoxy-2-(3-hydroxyoct-1-ynyl)-5-keto-cyclopentyl]enanthic acid methyl ester Formula: C23H36O6 MolecularWeight: 408.52834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36O6/c1-4-5-8-11-18(25)14-15-20-19(21(26)16-22(20)29-17(2)24)12-9-6-7-10-13-23(27)28-3/h18-20,22,25H,4-13,16H2,1-3H3