[(3S)-1-phenyloct-7-en-1-yn-3-yl] ethanoate

Systemtic Name: [(3S)-1-phenyloct-7-en-1-yn-3-yl] ethanoate Openeye Name: [(1S)-1-(2-phenylethynyl)hex-5-enyl] acetate CAS Name: acetic acid [(3S)-1-phenyloct-7-en-1-yn-3-yl] ester IUPAC Name: [(3S)-1-phenyloct-7-en-1-yn-3-yl] acetate Traditional Name: acetic acid [(1S)-1-(2-phenylethynyl)hex-5-enyl] ester Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O2/c1-3-4-6-11-16(18-14(2)17)13-12-15-9-7-5-8-10-15/h3,5,7-10,16H,1,4,6,11H2,2H3/t16-/m0/s1