methyl 7-(3-octyl-3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)-7-oxidanyl-heptanoate

Systemtic Name: methyl 7-(3-octyl-3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)-7-oxidanyl-heptanoate Openeye Name: methyl 7-hydroxy-7-(3-hydroxy-3-octyl-5-oxo-cyclopenten-1-yl)heptanoate CAS Name: 7-hydroxy-7-(3-hydroxy-3-octyl-5-oxo-1-cyclopentenyl)heptanoic acid methyl ester IUPAC Name: methyl 7-hydroxy-7-(3-hydroxy-3-octyl-5-oxocyclopenten-1-yl)heptanoate Traditional Name: 7-hydroxy-7-(3-hydroxy-5-keto-3-octyl-cyclopenten-1-yl)enanthic acid methyl ester Formula: C21H36O5 MolecularWeight: 368.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(CC(=O)C(=C1)C(CCCCCC(=O)OC)O)O

Isomeric SMILES

CCCCCCCCC1(CC(=O)C(=C1)C(CCCCCC(=O)OC)O)O

InChI

InChI=1S/C21H36O5/c1-3-4-5-6-7-11-14-21(25)15-17(19(23)16-21)18(22)12-9-8-10-13-20(24)26-2/h15,18,22,25H,3-14,16H2,1-2H3