[(1S)-1-[(2R,3S)-3-methyl-3-oct-1-ynyl-oxiran-2-yl]pent-4-enyl] ethanoate

Systemtic Name: [(1S)-1-[(2R,3S)-3-methyl-3-oct-1-ynyl-oxiran-2-yl]pent-4-enyl] ethanoate Openeye Name: [(1S)-1-[(2R,3S)-3-methyl-3-oct-1-ynyl-oxiran-2-yl]pent-4-enyl] acetate CAS Name: acetic acid [(1S)-1-[(2R,3S)-3-methyl-3-oct-1-ynyl-2-oxiranyl]pent-4-enyl] ester IUPAC Name: [(1S)-1-[(2R,3S)-3-methyl-3-oct-1-ynyloxiran-2-yl]pent-4-enyl] acetate Traditional Name: acetic acid [(1S)-1-[(2R,3S)-3-methyl-3-oct-1-ynyl-oxiran-2-yl]pent-4-enyl] ester Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1(C(O1)C(CCC=C)OC(=O)C)C

Isomeric SMILES

CCCCCCC#C[C@]1([C@H](O1)[C@H](CCC=C)OC(=O)C)C

InChI

InChI=1S/C18H28O3/c1-5-7-9-10-11-12-14-18(4)17(21-18)16(13-8-6-2)20-15(3)19/h6,16-17H,2,5,7-11,13H2,1,3-4H3/t16-,17+,18-/m0/s1