3-(2-bromophenyl)-2-(4-methylphenyl)sulfonyl-propanenitrile

Systemtic Name: 3-(2-bromophenyl)-2-(4-methylphenyl)sulfonyl-propanenitrile Openeye Name: 3-(2-bromophenyl)-2-(p-tolylsulfonyl)propanenitrile CAS Name: 3-(2-bromophenyl)-2-(4-methylphenyl)sulfonylpropanenitrile IUPAC Name: 3-(2-bromophenyl)-2-(4-methylphenyl)sulfonylpropanenitrile Traditional Name: 3-(2-bromophenyl)-2-tosyl-propionitrile Formula: C16H14BrNO2S MolecularWeight: 364.25686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC2=CC=CC=C2Br)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC2=CC=CC=C2Br)C#N

InChI

InChI=1S/C16H14BrNO2S/c1-12-6-8-14(9-7-12)21(19,20)15(11-18)10-13-4-2-3-5-16(13)17/h2-9,15H,10H2,1H3