4,4-dimethyl-1-phenyl-pent-2-yn-1-one

Systemtic Name: 4,4-dimethyl-1-phenyl-pent-2-yn-1-one Openeye Name: 4,4-dimethyl-1-phenyl-pent-2-yn-1-one CAS Name: 4,4-dimethyl-1-phenyl-2-pentyn-1-one IUPAC Name: 4,4-dimethyl-1-phenylpent-2-yn-1-one Traditional Name: 4,4-dimethyl-1-phenyl-pent-2-yn-1-one Formula: C13H14O MolecularWeight: 186.24966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O/c1-13(2,3)10-9-12(14)11-7-5-4-6-8-11/h4-8H,1-3H3