1-[(4-methylphenyl)sulfonylmethyl]-2-(2-phenylethynyl)benzene

Systemtic Name: 1-[(4-methylphenyl)sulfonylmethyl]-2-(2-phenylethynyl)benzene Openeye Name: 1-(2-phenylethynyl)-2-(p-tolylsulfonylmethyl)benzene CAS Name: 1-[(4-methylphenyl)sulfonylmethyl]-2-(2-phenylethynyl)benzene IUPAC Name: 1-[(4-methylphenyl)sulfonylmethyl]-2-(2-phenylethynyl)benzene Traditional Name: 1-(2-phenylethynyl)-2-(tosylmethyl)benzene Formula: C22H18O2S MolecularWeight: 346.44212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=CC=C2C#CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=CC=C2C#CC3=CC=CC=C3

InChI

InChI=1S/C22H18O2S/c1-18-11-15-22(16-12-18)25(23,24)17-21-10-6-5-9-20(21)14-13-19-7-3-2-4-8-19/h2-12,15-16H,17H2,1H3