5,5-dimethyl-1-phenyl-hex-3-yn-2-one

Systemtic Name: 5,5-dimethyl-1-phenyl-hex-3-yn-2-one Openeye Name: 5,5-dimethyl-1-phenyl-hex-3-yn-2-one CAS Name: 5,5-dimethyl-1-phenyl-3-hexyn-2-one IUPAC Name: 5,5-dimethyl-1-phenylhex-3-yn-2-one Traditional Name: 5,5-dimethyl-1-phenyl-hex-3-yn-2-one Formula: C14H16O MolecularWeight: 200.27624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O/c1-14(2,3)10-9-13(15)11-12-7-5-4-6-8-12/h4-8H,11H2,1-3H3