[(3S)-1-phenylhept-6-en-1-yn-3-yl] ethanoate

Systemtic Name: [(3S)-1-phenylhept-6-en-1-yn-3-yl] ethanoate Openeye Name: [(1S)-1-(2-phenylethynyl)pent-4-enyl] acetate CAS Name: acetic acid [(3S)-1-phenylhept-6-en-1-yn-3-yl] ester IUPAC Name: [(3S)-1-phenylhept-6-en-1-yn-3-yl] acetate Traditional Name: acetic acid [(1S)-1-(2-phenylethynyl)pent-4-enyl] ester Formula: C15H16O2 MolecularWeight: 228.28634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCC=C)C#CC1=CC=CC=C1

Isomeric SMILES

CC(=O)O[C@@H](CCC=C)C#CC1=CC=CC=C1

InChI

InChI=1S/C15H16O2/c1-3-4-10-15(17-13(2)16)12-11-14-8-6-5-7-9-14/h3,5-9,15H,1,4,10H2,2H3/t15-/m0/s1