(E)-2-methyl-7-[2-oxidanylidene-5-(3-oxidanyloctyl)cyclopentyl]hept-3-enoic acid

Systemtic Name: (E)-2-methyl-7-[2-oxidanylidene-5-(3-oxidanyloctyl)cyclopentyl]hept-3-enoic acid Openeye Name: (E)-7-[2-(3-hydroxyoctyl)-5-oxo-cyclopentyl]-2-methyl-hept-3-enoic acid CAS Name: (E)-7-[2-(3-hydroxyoctyl)-5-oxocyclopentyl]-2-methyl-3-heptenoic acid IUPAC Name: (E)-7-[2-(3-hydroxyoctyl)-5-oxocyclopentyl]-2-methylhept-3-enoic acid Traditional Name: (E)-7-[2-(3-hydroxyoctyl)-5-keto-cyclopentyl]-2-methyl-hept-3-enoic acid Formula: C21H36O4 MolecularWeight: 352.50814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1CCC(=O)C1CCCC=CC(C)C(=O)O)O

Isomeric SMILES

CCCCCC(CCC1CCC(=O)C1CCC/C=C/C(C)C(=O)O)O

InChI

InChI=1S/C21H36O4/c1-3-4-6-10-18(22)14-12-17-13-15-20(23)19(17)11-8-5-7-9-16(2)21(24)25/h7,9,16-19,22H,3-6,8,10-15H2,1-2H3,(H,24,25)/b9-7+