ethanenitrile; 1-methyl-2-(trifluoromethyl)benzene

Systemtic Name: ethanenitrile; 1-methyl-2-(trifluoromethyl)benzene Openeye Name: acetonitrile; 1-methyl-2-(trifluoromethyl)benzene CAS Name: acetonitrile; 1-methyl-2-(trifluoromethyl)benzene IUPAC Name: acetonitrile; 1-methyl-2-(trifluoromethyl)benzene Traditional Name: acetonitrile; 1-methyl-2-(trifluoromethyl)benzene Formula: C10H10F3N MolecularWeight: 201.18831

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CC#N.CC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C8H7F3.C2H3N/c1-6-4-2-3-5-7(6)8(9,10)11;1-2-3/h2-5H,1H3;1H3