[(5S)-9-phenylnon-1-en-6-yn-5-yl] ethanoate

Systemtic Name: [(5S)-9-phenylnon-1-en-6-yn-5-yl] ethanoate Openeye Name: [(1S)-1-(4-phenylbut-1-ynyl)pent-4-enyl] acetate CAS Name: acetic acid [(5S)-9-phenylnon-1-en-6-yn-5-yl] ester IUPAC Name: [(5S)-9-phenylnon-1-en-6-yn-5-yl] acetate Traditional Name: acetic acid [(1S)-1-(4-phenylbut-1-ynyl)pent-4-enyl] ester Formula: C17H20O2 MolecularWeight: 256.3395

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCC=C)C#CCCC1=CC=CC=C1

Isomeric SMILES

CC(=O)O[C@@H](CCC=C)C#CCCC1=CC=CC=C1

InChI

InChI=1S/C17H20O2/c1-3-4-13-17(19-15(2)18)14-9-8-12-16-10-6-5-7-11-16/h3,5-7,10-11,17H,1,4,8,12-13H2,2H3/t17-/m0/s1