7-[2-[3-(dioxidanyl)octyl]-1,2-dimethyl-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[3-(dioxidanyl)octyl]-1,2-dimethyl-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-(3-hydroperoxyoctyl)-3-hydroxy-1,2-dimethyl-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-(3-hydroperoxyoctyl)-3-hydroxy-1,2-dimethyl-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-(3-hydroperoxyoctyl)-3-hydroxy-1,2-dimethyl-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-(3-hydroperoxyoctyl)-3-hydroxy-5-keto-1,2-dimethyl-cyclopentyl]enanthic acid Formula: C22H40O6 MolecularWeight: 400.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1(C(CC(=O)C1(C)CCCCCCC(=O)O)O)C)OO

Isomeric SMILES

CCCCCC(CCC1(C(CC(=O)C1(C)CCCCCCC(=O)O)O)C)OO

InChI

InChI=1S/C22H40O6/c1-4-5-8-11-17(28-27)13-15-22(3)19(24)16-18(23)21(22,2)14-10-7-6-9-12-20(25)26/h17,19,24,27H,4-16H2,1-3H3,(H,25,26)