[2,6-dimethyl-7,8-bis(oxidanyl)-5-oxidanylidene-octan-2-yl] ethanoate

Systemtic Name: [2,6-dimethyl-7,8-bis(oxidanyl)-5-oxidanylidene-octan-2-yl] ethanoate Openeye Name: (6,7-dihydroxy-1,1,5-trimethyl-4-oxo-heptyl) acetate CAS Name: acetic acid (7,8-dihydroxy-2,6-dimethyl-5-oxooctan-2-yl) ester IUPAC Name: (7,8-dihydroxy-2,6-dimethyl-5-oxooctan-2-yl) acetate Traditional Name: acetic acid (6,7-dihydroxy-4-keto-1,1,5-trimethyl-heptyl) ester Formula: C12H22O5 MolecularWeight: 246.30008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O5/c1-8(11(16)7-13)10(15)5-6-12(3,4)17-9(2)14/h8,11,13,16H,5-7H2,1-4H3