5,5-dimethyl-1-(phenylsulfonyl)hex-3-yn-2-one

Systemtic Name: 5,5-dimethyl-1-(phenylsulfonyl)hex-3-yn-2-one Openeye Name: 1-(benzenesulfonyl)-5,5-dimethyl-hex-3-yn-2-one CAS Name: 1-(benzenesulfonyl)-5,5-dimethyl-3-hexyn-2-one IUPAC Name: 1-(benzenesulfonyl)-5,5-dimethylhex-3-yn-2-one Traditional Name: 1-besyl-5,5-dimethyl-hex-3-yn-2-one Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3S/c1-14(2,3)10-9-12(15)11-18(16,17)13-7-5-4-6-8-13/h4-8H,11H2,1-3H3