3-(2,4-dimethylphenyl)-3-oxidanylidene-2-[5-(trifluoromethyl)pyridin-2-yl]propanenitrile

Systemtic Name: 3-(2,4-dimethylphenyl)-3-oxidanylidene-2-[5-(trifluoromethyl)pyridin-2-yl]propanenitrile Openeye Name: 3-(2,4-dimethylphenyl)-3-oxo-2-[5-(trifluoromethyl)-2-pyridyl]propanenitrile CAS Name: 3-(2,4-dimethylphenyl)-3-oxo-2-[5-(trifluoromethyl)-2-pyridinyl]propanenitrile IUPAC Name: 3-(2,4-dimethylphenyl)-3-oxo-2-[5-(trifluoromethyl)pyridin-2-yl]propanenitrile Traditional Name: 3-(2,4-dimethylphenyl)-3-keto-2-[5-(trifluoromethyl)-2-pyridyl]propionitrile Formula: C17H13F3N2O MolecularWeight: 318.29313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13F3N2O/c1-10-3-5-13(11(2)7-10)16(23)14(8-21)15-6-4-12(9-22-15)17(18,19)20/h3-7,9,14H,1-2H3