1-[2-(2-phenylethynyl)phenyl]hex-2-yn-1-one

Systemtic Name: 1-[2-(2-phenylethynyl)phenyl]hex-2-yn-1-one Openeye Name: 1-[2-(2-phenylethynyl)phenyl]hex-2-yn-1-one CAS Name: 1-[2-(2-phenylethynyl)phenyl]-2-hexyn-1-one IUPAC Name: 1-[2-(2-phenylethynyl)phenyl]hex-2-yn-1-one Traditional Name: 1-[2-(2-phenylethynyl)phenyl]hex-2-yn-1-one Formula: C20H16O MolecularWeight: 272.34044

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2

Isomeric SMILES

CCCC#CC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2

InChI

InChI=1S/C20H16O/c1-2-3-5-14-20(21)19-13-9-8-12-18(19)16-15-17-10-6-4-7-11-17/h4,6-13H,2-3H2,1H3