ethyl 6-[2-oxidanylidene-6-(3-oxidanyloct-4-ynyl)cyclohexyl]hexanoate

Systemtic Name: ethyl 6-[2-oxidanylidene-6-(3-oxidanyloct-4-ynyl)cyclohexyl]hexanoate Openeye Name: ethyl 6-[2-(3-hydroxyoct-4-ynyl)-6-oxo-cyclohexyl]hexanoate CAS Name: 6-[2-(3-hydroxyoct-4-ynyl)-6-oxocyclohexyl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-(3-hydroxyoct-4-ynyl)-6-oxocyclohexyl]hexanoate Traditional Name: 6-[2-(3-hydroxyoct-4-ynyl)-6-keto-cyclohexyl]hexanoic acid ethyl ester Formula: C22H36O4 MolecularWeight: 364.51884

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(CCC1CCCC(=O)C1CCCCCC(=O)OCC)O

Isomeric SMILES

CCCC#CC(CCC1CCCC(=O)C1CCCCCC(=O)OCC)O

InChI

InChI=1S/C22H36O4/c1-3-5-7-12-19(23)17-16-18-11-10-14-21(24)20(18)13-8-6-9-15-22(25)26-4-2/h18-20,23H,3-6,8-11,13-17H2,1-2H3