7-[2-oxidanylidene-6-(3-oxidanyloct-4-ynyl)cyclohexyl]heptanoic acid

Systemtic Name: 7-[2-oxidanylidene-6-(3-oxidanyloct-4-ynyl)cyclohexyl]heptanoic acid Openeye Name: 7-[2-(3-hydroxyoct-4-ynyl)-6-oxo-cyclohexyl]heptanoic acid CAS Name: 7-[2-(3-hydroxyoct-4-ynyl)-6-oxocyclohexyl]heptanoic acid IUPAC Name: 7-[2-(3-hydroxyoct-4-ynyl)-6-oxocyclohexyl]heptanoic acid Traditional Name: 7-[2-(3-hydroxyoct-4-ynyl)-6-keto-cyclohexyl]enanthic acid Formula: C21H34O4 MolecularWeight: 350.49226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(CCC1CCCC(=O)C1CCCCCCC(=O)O)O

Isomeric SMILES

CCCC#CC(CCC1CCCC(=O)C1CCCCCCC(=O)O)O

InChI

InChI=1S/C21H34O4/c1-2-3-6-11-18(22)16-15-17-10-9-13-20(23)19(17)12-7-4-5-8-14-21(24)25/h17-19,22H,2-5,7-10,12-16H2,1H3,(H,24,25)