1-(3,5-ditert-butylphenyl)hex-5-yn-1-one

Systemtic Name: 1-(3,5-ditert-butylphenyl)hex-5-yn-1-one Openeye Name: 1-(3,5-ditert-butylphenyl)hex-5-yn-1-one CAS Name: 1-(3,5-ditert-butylphenyl)-5-hexyn-1-one IUPAC Name: 1-(3,5-ditert-butylphenyl)hex-5-yn-1-one Traditional Name: 1-(3,5-ditert-butylphenyl)hex-5-yn-1-one Formula: C20H28O MolecularWeight: 284.43572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28O/c1-8-9-10-11-18(21)15-12-16(19(2,3)4)14-17(13-15)20(5,6)7/h1,12-14H,9-11H2,2-7H3