(2,2-dimethyl-5-oxidanylidene-octan-3-yl) ethanoate

Systemtic Name: (2,2-dimethyl-5-oxidanylidene-octan-3-yl) ethanoate Openeye Name: (1-tert-butyl-3-oxo-hexyl) acetate CAS Name: acetic acid (2,2-dimethyl-5-oxooctan-3-yl) ester IUPAC Name: (2,2-dimethyl-5-oxooctan-3-yl) acetate Traditional Name: acetic acid (1-tert-butyl-3-keto-hexyl) ester Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O3/c1-6-7-10(14)8-11(12(3,4)5)15-9(2)13/h11H,6-8H2,1-5H3