3-methyl-1-phenyl-hex-5-yn-1-one

Systemtic Name: 3-methyl-1-phenyl-hex-5-yn-1-one Openeye Name: 3-methyl-1-phenyl-hex-5-yn-1-one CAS Name: 3-methyl-1-phenyl-5-hexyn-1-one IUPAC Name: 3-methyl-1-phenylhex-5-yn-1-one Traditional Name: 3-methyl-1-phenyl-hex-5-yn-1-one Formula: C13H14O MolecularWeight: 186.24966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O/c1-3-7-11(2)10-13(14)12-8-5-4-6-9-12/h1,4-6,8-9,11H,7,10H2,2H3