6-[3-(5,5-dimethyl-6-oxidanyl-6-oxidanylidene-hexoxy)phenoxy]-2,2-dimethyl-hexanoic acid

Systemtic Name: 6-[3-(5,5-dimethyl-6-oxidanyl-6-oxidanylidene-hexoxy)phenoxy]-2,2-dimethyl-hexanoic acid Openeye Name: 6-[3-(6-hydroxy-5,5-dimethyl-6-oxo-hexoxy)phenoxy]-2,2-dimethyl-hexanoic acid CAS Name: 6-[3-(6-hydroxy-5,5-dimethyl-6-oxohexoxy)phenoxy]-2,2-dimethylhexanoic acid IUPAC Name: 6-[3-(6-hydroxy-5,5-dimethyl-6-oxohexoxy)phenoxy]-2,2-dimethylhexanoic acid Traditional Name: 6-[3-(6-hydroxy-6-keto-5,5-dimethyl-hexoxy)phenoxy]-2,2-dimethyl-hexanoic acid Formula: C22H34O6 MolecularWeight: 394.50176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC(=CC=C1)OCCCCC(C)(C)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(CCCCOC1=CC(=CC=C1)OCCCCC(C)(C)C(=O)O)C(=O)O

InChI

InChI=1S/C22H34O6/c1-21(2,19(23)24)12-5-7-14-27-17-10-9-11-18(16-17)28-15-8-6-13-22(3,4)20(25)26/h9-11,16H,5-8,12-15H2,1-4H3,(H,23,24)(H,25,26)