[(3S,4R)-3-methyl-1-oxidanyl-nonan-4-yl] ethanoate

Systemtic Name: [(3S,4R)-3-methyl-1-oxidanyl-nonan-4-yl] ethanoate Openeye Name: [(1R)-1-[(1S)-3-hydroxy-1-methyl-propyl]hexyl] acetate CAS Name: acetic acid [(3S,4R)-1-hydroxy-3-methylnonan-4-yl] ester IUPAC Name: [(3S,4R)-1-hydroxy-3-methylnonan-4-yl] acetate Traditional Name: acetic acid [(1R)-1-[(1S)-3-hydroxy-1-methyl-propyl]hexyl] ester Formula: C12H24O3 MolecularWeight: 216.31716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)CCO)OC(=O)C

Isomeric SMILES

CCCCC[C@H]([C@@H](C)CCO)OC(=O)C

InChI

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