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2-(4-methylphenyl)sulfonyl-2-[3-(trifluoromethyl)phenyl]ethanenitrile

2-(4-methylphenyl)sulfonyl-2-[3-(trifluoromethyl)phenyl]ethanenitrile

Systemtic Name:2-(4-methylphenyl)sulfonyl-2-[3-(trifluoromethyl)phenyl]ethanenitrile
Openeye Name:2-(p-tolylsulfonyl)-2-[3-(trifluoromethyl)phenyl]acetonitrile
CAS Name:2-(4-methylphenyl)sulfonyl-2-[3-(trifluoromethyl)phenyl]acetonitrile
IUPAC Name:2-(4-methylphenyl)sulfonyl-2-[3-(trifluoromethyl)phenyl]acetonitrile
Traditional Name:2-tosyl-2-[3-(trifluoromethyl)phenyl]acetonitrile
Formula: C16H12F3NO2S
MolecularWeight: 339.33219
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=CC(=CC=C2)C(F)(F)F


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=CC(=CC=C2)C(F)(F)F


InChI

InChI=1S/C16H12F3NO2S/c1-11-5-7-14(8-6-11)23(21,22)15(10-20)12-3-2-4-13(9-12)16(17,18)19/h2-9,15H,1H3


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