1-(4-methylphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one

Systemtic Name: 1-(4-methylphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Openeye Name: 3-(4-methylsulfonylphenyl)-1-(p-tolyl)prop-2-yn-1-one CAS Name: 1-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-2-propyn-1-one IUPAC Name: 1-(4-methylphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Traditional Name: 3-(4-mesylphenyl)-1-(p-tolyl)prop-2-yn-1-one Formula: C17H14O3S MolecularWeight: 298.35626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C#CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C#CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H14O3S/c1-13-3-8-15(9-4-13)17(18)12-7-14-5-10-16(11-6-14)21(2,19)20/h3-6,8-11H,1-2H3