6-(2,2-dimethyl-3-oxidanyl-propoxy)-6-oxidanylidene-hexanoic acid; hexane-1,6-diol

Systemtic Name: 6-(2,2-dimethyl-3-oxidanyl-propoxy)-6-oxidanylidene-hexanoic acid; hexane-1,6-diol Openeye Name: hexane-1,6-diol; 6-(3-hydroxy-2,2-dimethyl-propoxy)-6-oxo-hexanoic acid CAS Name: hexane-1,6-diol; 6-(3-hydroxy-2,2-dimethylpropoxy)-6-oxohexanoic acid IUPAC Name: hexane-1,6-diol; 6-(3-hydroxy-2,2-dimethylpropoxy)-6-oxohexanoic acid Traditional Name: hexane-1,6-diol; 6-(3-hydroxy-2,2-dimethyl-propoxy)-6-keto-hexanoic acid Formula: C17H34O7 MolecularWeight: 350.44766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)COC(=O)CCCCC(=O)O.C(CCCO)CCO

Isomeric SMILES

CC(C)(CO)COC(=O)CCCCC(=O)O.C(CCCO)CCO

InChI

InChI=1S/C11H20O5.C6H14O2/c1-11(2,7-12)8-16-10(15)6-4-3-5-9(13)14;7-5-3-1-2-4-6-8/h12H,3-8H2,1-2H3,(H,13,14);7-8H,1-6H2