hexyl 9-[5-oxidanylidene-3-(2-oxidanyloxan-2-yl)cyclopenten-1-yl]nonanoate

Systemtic Name: hexyl 9-[5-oxidanylidene-3-(2-oxidanyloxan-2-yl)cyclopenten-1-yl]nonanoate Openeye Name: hexyl 9-[3-(2-hydroxytetrahydropyran-2-yl)-5-oxo-cyclopenten-1-yl]nonanoate CAS Name: 9-[3-(2-hydroxy-2-oxanyl)-5-oxo-1-cyclopentenyl]nonanoic acid hexyl ester IUPAC Name: hexyl 9-[3-(2-hydroxyoxan-2-yl)-5-oxocyclopenten-1-yl]nonanoate Traditional Name: 9-[3-(2-hydroxytetrahydropyran-2-yl)-5-keto-cyclopenten-1-yl]pelargonic acid hexyl ester Formula: C25H42O5 MolecularWeight: 422.59798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCCCCCCC1=CC(CC1=O)C2(CCCCO2)O

Isomeric SMILES

CCCCCCOC(=O)CCCCCCCCC1=CC(CC1=O)C2(CCCCO2)O

InChI

InChI=1S/C25H42O5/c1-2-3-4-12-17-29-24(27)15-10-8-6-5-7-9-14-21-19-22(20-23(21)26)25(28)16-11-13-18-30-25/h19,22,28H,2-18,20H2,1H3