1-(2-hex-1-ynylphenyl)but-2-yn-1-one

Systemtic Name: 1-(2-hex-1-ynylphenyl)but-2-yn-1-one Openeye Name: 1-(2-hex-1-ynylphenyl)but-2-yn-1-one CAS Name: 1-(2-hex-1-ynylphenyl)-2-butyn-1-one IUPAC Name: 1-(2-hex-1-ynylphenyl)but-2-yn-1-one Traditional Name: 1-(2-hex-1-ynylphenyl)but-2-yn-1-one Formula: C16H16O MolecularWeight: 224.29764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC=CC=C1C(=O)C#CC

Isomeric SMILES

CCCCC#CC1=CC=CC=C1C(=O)C#CC

InChI

InChI=1S/C16H16O/c1-3-5-6-7-11-14-12-8-9-13-15(14)16(17)10-4-2/h8-9,12-13H,3,5-6H2,1-2H3