6-(4-methylphenyl)hex-5-yn-2-one

Systemtic Name: 6-(4-methylphenyl)hex-5-yn-2-one Openeye Name: 6-(p-tolyl)hex-5-yn-2-one CAS Name: 6-(4-methylphenyl)-5-hexyn-2-one IUPAC Name: 6-(4-methylphenyl)hex-5-yn-2-one Traditional Name: 6-(p-tolyl)hex-5-yn-2-one Formula: C13H14O MolecularWeight: 186.24966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O/c1-11-7-9-13(10-8-11)6-4-3-5-12(2)14/h7-10H,3,5H2,1-2H3