[(2S,4S,6S)-2,4,6-trimethyl-7-oxidanyl-heptyl] ethanoate

Systemtic Name: [(2S,4S,6S)-2,4,6-trimethyl-7-oxidanyl-heptyl] ethanoate Openeye Name: [(2S,4S,6S)-7-hydroxy-2,4,6-trimethyl-heptyl] acetate CAS Name: acetic acid [(2S,4S,6S)-7-hydroxy-2,4,6-trimethylheptyl] ester IUPAC Name: [(2S,4S,6S)-7-hydroxy-2,4,6-trimethylheptyl] acetate Traditional Name: acetic acid [(2S,4S,6S)-7-hydroxy-2,4,6-trimethyl-heptyl] ester Formula: C12H24O3 MolecularWeight: 216.31716

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)CO)CC(C)COC(=O)C

Isomeric SMILES

C[C@@H](C[C@H](C)CO)C[C@H](C)COC(=O)C

InChI

InChI=1S/C12H24O3/c1-9(5-10(2)7-13)6-11(3)8-15-12(4)14/h9-11,13H,5-8H2,1-4H3/t9-,10-,11-/m0/s1