[3-(2-hydroxyethyl)-2-methyl-6-oxidanylidene-heptan-2-yl] ethanoate

Systemtic Name: [3-(2-hydroxyethyl)-2-methyl-6-oxidanylidene-heptan-2-yl] ethanoate Openeye Name: [2-(2-hydroxyethyl)-1,1-dimethyl-5-oxo-hexyl] acetate CAS Name: acetic acid [3-(2-hydroxyethyl)-2-methyl-6-oxoheptan-2-yl] ester IUPAC Name: [3-(2-hydroxyethyl)-2-methyl-6-oxoheptan-2-yl] acetate Traditional Name: acetic acid [2-(2-hydroxyethyl)-5-keto-1,1-dimethyl-hexyl] ester Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(CCO)C(C)(C)OC(=O)C

Isomeric SMILES

CC(=O)CCC(CCO)C(C)(C)OC(=O)C

InChI

InChI=1S/C12H22O4/c1-9(14)5-6-11(7-8-13)12(3,4)16-10(2)15/h11,13H,5-8H2,1-4H3