3-(4-methylsulfonylphenyl)-2-(2-phenylethynyl)cyclopent-2-en-1-one

Systemtic Name: 3-(4-methylsulfonylphenyl)-2-(2-phenylethynyl)cyclopent-2-en-1-one Openeye Name: 3-(4-methylsulfonylphenyl)-2-(2-phenylethynyl)cyclopent-2-en-1-one CAS Name: 3-(4-methylsulfonylphenyl)-2-(2-phenylethynyl)-1-cyclopent-2-enone IUPAC Name: 3-(4-methylsulfonylphenyl)-2-(2-phenylethynyl)cyclopent-2-en-1-one Traditional Name: 3-(4-mesylphenyl)-2-(2-phenylethynyl)cyclopent-2-en-1-one Formula: C20H16O3S MolecularWeight: 336.40424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)CC2)C#CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)CC2)C#CC3=CC=CC=C3

InChI

InChI=1S/C20H16O3S/c1-24(22,23)17-10-8-16(9-11-17)18-13-14-20(21)19(18)12-7-15-5-3-2-4-6-15/h2-6,8-11H,13-14H2,1H3