2-[[2-fluoranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanenitrile

Systemtic Name: 2-[[2-fluoranyl-4-(trifluoromethyl)phenyl]amino]-3-methyl-butanenitrile Openeye Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methyl-butanenitrile CAS Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methylbutanenitrile IUPAC Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methylbutanenitrile Traditional Name: 2-[2-fluoro-4-(trifluoromethyl)anilino]-3-methyl-butyronitrile Formula: C12H12F4N2 MolecularWeight: 260.230693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)NC1=C(C=C(C=C1)C(F)(F)F)F

Isomeric SMILES

CC(C)C(C#N)NC1=C(C=C(C=C1)C(F)(F)F)F

InChI

InChI=1S/C12H12F4N2/c1-7(2)11(6-17)18-10-4-3-8(5-9(10)13)12(14,15)16/h3-5,7,11,18H,1-2H3