[5,5-dimethyl-8-(5-oxidanyl-3-oxidanylidene-cyclopenten-1-yl)oct-7-yn-2-yl] heptanoate

Systemtic Name: [5,5-dimethyl-8-(5-oxidanyl-3-oxidanylidene-cyclopenten-1-yl)oct-7-yn-2-yl] heptanoate Openeye Name: [7-(5-hydroxy-3-oxo-cyclopenten-1-yl)-1,4,4-trimethyl-hept-6-ynyl] heptanoate CAS Name: heptanoic acid [8-(5-hydroxy-3-oxo-1-cyclopentenyl)-5,5-dimethyloct-7-yn-2-yl] ester IUPAC Name: [8-(5-hydroxy-3-oxocyclopenten-1-yl)-5,5-dimethyloct-7-yn-2-yl] heptanoate Traditional Name: enanthic acid [7-(5-hydroxy-3-keto-cyclopenten-1-yl)-1,4,4-trimethyl-hept-6-ynyl] ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(C)CCC(C)(C)CC#CC1=CC(=O)CC1O

Isomeric SMILES

CCCCCCC(=O)OC(C)CCC(C)(C)CC#CC1=CC(=O)CC1O

InChI

InChI=1S/C22H34O4/c1-5-6-7-8-11-21(25)26-17(2)12-14-22(3,4)13-9-10-18-15-19(23)16-20(18)24/h15,17,20,24H,5-8,11-14,16H2,1-4H3