[(3S,5R)-2,3-dimethyl-2-oxidanyl-nonan-5-yl] ethanoate

Systemtic Name: [(3S,5R)-2,3-dimethyl-2-oxidanyl-nonan-5-yl] ethanoate Openeye Name: [(1R,3S)-1-butyl-4-hydroxy-3,4-dimethyl-pentyl] acetate CAS Name: acetic acid [(3S,5R)-2-hydroxy-2,3-dimethylnonan-5-yl] ester IUPAC Name: [(3S,5R)-2-hydroxy-2,3-dimethylnonan-5-yl] acetate Traditional Name: acetic acid [(1R,3S)-1-butyl-4-hydroxy-3,4-dimethyl-pentyl] ester Formula: C13H26O3 MolecularWeight: 230.34374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)C(C)(C)O)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H26O3/c1-6-7-8-12(16-11(3)14)9-10(2)13(4,5)15/h10,12,15H,6-9H2,1-5H3/t10-,12+/m0/s1