[(4R,5S)-5-acetyloxy-4,6-dimethyl-3-oxidanylidene-heptyl] ethanoate

Systemtic Name: [(4R,5S)-5-acetyloxy-4,6-dimethyl-3-oxidanylidene-heptyl] ethanoate Openeye Name: [(4R,5S)-5-acetoxy-4,6-dimethyl-3-oxo-heptyl] acetate CAS Name: acetic acid [(4R,5S)-5-acetyloxy-4,6-dimethyl-3-oxoheptyl] ester IUPAC Name: [(4R,5S)-5-acetyloxy-4,6-dimethyl-3-oxoheptyl] acetate Traditional Name: acetic acid [(4R,5S)-5-acetoxy-3-keto-4,6-dimethyl-heptyl] ester Formula: C13H22O5 MolecularWeight: 258.31078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C(=O)CCOC(=O)C)OC(=O)C

Isomeric SMILES

C[C@H]([C@H](C(C)C)OC(=O)C)C(=O)CCOC(=O)C

InChI

InChI=1S/C13H22O5/c1-8(2)13(18-11(5)15)9(3)12(16)6-7-17-10(4)14/h8-9,13H,6-7H2,1-5H3/t9-,13-/m0/s1