2-(4-ethanoylphenyl)-2-(phenylsulfonyl)ethanenitrile

Systemtic Name: 2-(4-ethanoylphenyl)-2-(phenylsulfonyl)ethanenitrile Openeye Name: 2-(4-acetylphenyl)-2-(benzenesulfonyl)acetonitrile CAS Name: 2-(4-acetylphenyl)-2-(benzenesulfonyl)acetonitrile IUPAC Name: 2-(4-acetylphenyl)-2-(benzenesulfonyl)acetonitrile Traditional Name: 2-(4-acetylphenyl)-2-besyl-acetonitrile Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H13NO3S/c1-12(18)13-7-9-14(10-8-13)16(11-17)21(19,20)15-5-3-2-4-6-15/h2-10,16H,1H3