1-[2-(2-phenylethynyl)phenyl]hept-6-en-1-one

Systemtic Name: 1-[2-(2-phenylethynyl)phenyl]hept-6-en-1-one Openeye Name: 1-[2-(2-phenylethynyl)phenyl]hept-6-en-1-one CAS Name: 1-[2-(2-phenylethynyl)phenyl]-6-hepten-1-one IUPAC Name: 1-[2-(2-phenylethynyl)phenyl]hept-6-en-1-one Traditional Name: 1-[2-(2-phenylethynyl)phenyl]hept-6-en-1-one Formula: C21H20O MolecularWeight: 288.3829

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2

Isomeric SMILES

C=CCCCCC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2

InChI

InChI=1S/C21H20O/c1-2-3-4-8-15-21(22)20-14-10-9-13-19(20)17-16-18-11-6-5-7-12-18/h2,5-7,9-14H,1,3-4,8,15H2