[(E)-1-phenylpent-1-en-4-yn-3-yl] ethanoate

Systemtic Name: [(E)-1-phenylpent-1-en-4-yn-3-yl] ethanoate Openeye Name: [(E)-1-ethynyl-3-phenyl-allyl] acetate CAS Name: acetic acid [(E)-1-phenylpent-1-en-4-yn-3-yl] ester IUPAC Name: [(E)-1-phenylpent-1-en-4-yn-3-yl] acetate Traditional Name: acetic acid [(E)-1-ethynyl-3-phenyl-allyl] ester Formula: C13H12O2 MolecularWeight: 200.23318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)OC(/C=C/C1=CC=CC=C1)C#C

InChI

InChI=1S/C13H12O2/c1-3-13(15-11(2)14)10-9-12-7-5-4-6-8-12/h1,4-10,13H,2H3/b10-9+