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

Systemtic Name: 1-(3-hydroxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Openeye Name: 1-(3-hydroxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one CAS Name: 1-(3-hydroxyphenyl)-3-(4-methylsulfonylphenyl)-2-propyn-1-one IUPAC Name: 1-(3-hydroxyphenyl)-3-(4-methylsulfonylphenyl)prop-2-yn-1-one Traditional Name: 1-(3-hydroxyphenyl)-3-(4-mesylphenyl)prop-2-yn-1-one Formula: C16H12O4S MolecularWeight: 300.32908

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C#CC(=O)C2=CC(=CC=C2)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C#CC(=O)C2=CC(=CC=C2)O

InChI

InChI=1S/C16H12O4S/c1-21(19,20)15-8-5-12(6-9-15)7-10-16(18)13-3-2-4-14(17)11-13/h2-6,8-9,11,17H,1H3