[(3S,7S)-3,7-dimethyl-8-oxidanyl-octyl] ethanoate

Systemtic Name: [(3S,7S)-3,7-dimethyl-8-oxidanyl-octyl] ethanoate Openeye Name: [(3S,7S)-8-hydroxy-3,7-dimethyl-octyl] acetate CAS Name: acetic acid [(3S,7S)-8-hydroxy-3,7-dimethyloctyl] ester IUPAC Name: [(3S,7S)-8-hydroxy-3,7-dimethyloctyl] acetate Traditional Name: acetic acid [(3S,7S)-8-hydroxy-3,7-dimethyl-octyl] ester Formula: C12H24O3 MolecularWeight: 216.31716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)CO)CCOC(=O)C

Isomeric SMILES

C[C@@H](CCC[C@H](C)CO)CCOC(=O)C

InChI

InChI=1S/C12H24O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h10-11,13H,4-9H2,1-3H3/t10-,11-/m0/s1