2-[(4-methylphenyl)methylsulfonyl]-2-phenyl-ethanenitrile

Systemtic Name: 2-[(4-methylphenyl)methylsulfonyl]-2-phenyl-ethanenitrile Openeye Name: 2-phenyl-2-(p-tolylmethylsulfonyl)acetonitrile CAS Name: 2-[(4-methylphenyl)methylsulfonyl]-2-phenylacetonitrile IUPAC Name: 2-[(4-methylphenyl)methylsulfonyl]-2-phenylacetonitrile Traditional Name: 2-(4-methylbenzyl)sulfonyl-2-phenyl-acetonitrile Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)C(C#N)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C16H15NO2S/c1-13-7-9-14(10-8-13)12-20(18,19)16(11-17)15-5-3-2-4-6-15/h2-10,16H,12H2,1H3