7-(3,3-dimethylbut-1-ynylsulfinyl)-1-phenyl-hept-2-yn-1-one

Systemtic Name: 7-(3,3-dimethylbut-1-ynylsulfinyl)-1-phenyl-hept-2-yn-1-one Openeye Name: 7-(3,3-dimethylbut-1-ynylsulfinyl)-1-phenyl-hept-2-yn-1-one CAS Name: 7-(3,3-dimethylbut-1-ynylsulfinyl)-1-phenyl-2-heptyn-1-one IUPAC Name: 7-(3,3-dimethylbut-1-ynylsulfinyl)-1-phenylhept-2-yn-1-one Traditional Name: 7-(3,3-dimethylbut-1-ynylsulfinyl)-1-phenyl-hept-2-yn-1-one Formula: C19H22O2S MolecularWeight: 314.44178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22O2S/c1-19(2,3)14-16-22(21)15-10-5-4-9-13-18(20)17-11-7-6-8-12-17/h6-8,11-12H,4-5,10,15H2,1-3H3