[(3S)-non-1-yn-3-yl] ethanoate

Systemtic Name: [(3S)-non-1-yn-3-yl] ethanoate Openeye Name: [(1S)-1-ethynylheptyl] acetate CAS Name: acetic acid [(3S)-non-1-yn-3-yl] ester IUPAC Name: [(3S)-non-1-yn-3-yl] acetate Traditional Name: acetic acid [(1S)-1-hexylprop-2-ynyl] ester Formula: C11H18O2 MolecularWeight: 182.25942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C#C)OC(=O)C

Isomeric SMILES

CCCCCC[C@@H](C#C)OC(=O)C

InChI

InChI=1S/C11H18O2/c1-4-6-7-8-9-11(5-2)13-10(3)12/h2,11H,4,6-9H2,1,3H3/t11-/m1/s1