(3,7-dimethyl-7-oxidanyl-6-oxidanylidene-octyl) ethanoate

Systemtic Name: (3,7-dimethyl-7-oxidanyl-6-oxidanylidene-octyl) ethanoate Openeye Name: (7-hydroxy-3,7-dimethyl-6-oxo-octyl) acetate CAS Name: acetic acid (7-hydroxy-3,7-dimethyl-6-oxooctyl) ester IUPAC Name: (7-hydroxy-3,7-dimethyl-6-oxooctyl) acetate Traditional Name: acetic acid (7-hydroxy-6-keto-3,7-dimethyl-octyl) ester Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)C(C)(C)O)CCOC(=O)C

Isomeric SMILES

CC(CCC(=O)C(C)(C)O)CCOC(=O)C

InChI

InChI=1S/C12H22O4/c1-9(7-8-16-10(2)13)5-6-11(14)12(3,4)15/h9,15H,5-8H2,1-4H3