3-[[3-(trifluoromethyloxy)phenyl]amino]pentanenitrile

Systemtic Name: 3-[[3-(trifluoromethyloxy)phenyl]amino]pentanenitrile Openeye Name: 3-[3-(trifluoromethoxy)anilino]pentanenitrile CAS Name: 3-[3-(trifluoromethoxy)anilino]pentanenitrile IUPAC Name: 3-[3-(trifluoromethoxy)anilino]pentanenitrile Traditional Name: 3-[3-(trifluoromethoxy)anilino]valeronitrile Formula: C12H13F3N2O MolecularWeight: 258.23963

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)NC1=CC(=CC=C1)OC(F)(F)F

Isomeric SMILES

CCC(CC#N)NC1=CC(=CC=C1)OC(F)(F)F

InChI

InChI=1S/C12H13F3N2O/c1-2-9(6-7-16)17-10-4-3-5-11(8-10)18-12(13,14)15/h3-5,8-9,17H,2,6H2,1H3