5-methyl-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 5-methyl-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 5-methyl-2-(trifluoromethyl)benzonitrile CAS Name: 5-methyl-2-(trifluoromethyl)benzonitrile IUPAC Name: 5-methyl-2-(trifluoromethyl)benzonitrile Traditional Name: 5-methyl-2-(trifluoromethyl)benzonitrile Formula: C9H6F3N MolecularWeight: 185.14585

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C(F)(F)F)C#N

InChI

InChI=1S/C9H6F3N/c1-6-2-3-8(9(10,11)12)7(4-6)5-13/h2-4H,1H3