1-(4-chlorophenyl)-4,4-dimethyl-pent-2-yn-1-one

Systemtic Name: 1-(4-chlorophenyl)-4,4-dimethyl-pent-2-yn-1-one Openeye Name: 1-(4-chlorophenyl)-4,4-dimethyl-pent-2-yn-1-one CAS Name: 1-(4-chlorophenyl)-4,4-dimethyl-2-pentyn-1-one IUPAC Name: 1-(4-chlorophenyl)-4,4-dimethylpent-2-yn-1-one Traditional Name: 1-(4-chlorophenyl)-4,4-dimethyl-pent-2-yn-1-one Formula: C13H13ClO MolecularWeight: 220.69472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClO/c1-13(2,3)9-8-12(15)10-4-6-11(14)7-5-10/h4-7H,1-3H3