6-methyl-3-oxidanylidene-2-[3-(trifluoromethyl)phenyl]heptanenitrile

Systemtic Name: 6-methyl-3-oxidanylidene-2-[3-(trifluoromethyl)phenyl]heptanenitrile Openeye Name: 6-methyl-3-oxo-2-[3-(trifluoromethyl)phenyl]heptanenitrile CAS Name: 6-methyl-3-oxo-2-[3-(trifluoromethyl)phenyl]heptanenitrile IUPAC Name: 6-methyl-3-oxo-2-[3-(trifluoromethyl)phenyl]heptanenitrile Traditional Name: 3-keto-6-methyl-2-[3-(trifluoromethyl)phenyl]enanthonitrile Formula: C15H16F3NO MolecularWeight: 283.28885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)C(C#N)C1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CC(C)CCC(=O)C(C#N)C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C15H16F3NO/c1-10(2)6-7-14(20)13(9-19)11-4-3-5-12(8-11)15(16,17)18/h3-5,8,10,13H,6-7H2,1-2H3