(2,6-dimethyl-5-oxidanyl-4-oxidanylidene-heptan-3-yl) ethanoate

Systemtic Name: (2,6-dimethyl-5-oxidanyl-4-oxidanylidene-heptan-3-yl) ethanoate Openeye Name: (3-hydroxy-1-isopropyl-4-methyl-2-oxo-pentyl) acetate CAS Name: acetic acid (5-hydroxy-2,6-dimethyl-4-oxoheptan-3-yl) ester IUPAC Name: (5-hydroxy-2,6-dimethyl-4-oxoheptan-3-yl) acetate Traditional Name: acetic acid (3-hydroxy-1-isopropyl-2-keto-4-methyl-pentyl) ester Formula: C11H20O4 MolecularWeight: 216.2741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C(C)C)OC(=O)C)O

Isomeric SMILES

CC(C)C(C(=O)C(C(C)C)OC(=O)C)O

InChI

InChI=1S/C11H20O4/c1-6(2)9(13)10(14)11(7(3)4)15-8(5)12/h6-7,9,11,13H,1-5H3