2-[[4-cyano-3-(trifluoromethyl)phenyl]-[2,2,2-tris(fluoranyl)ethyl]amino]-N-ethyl-butanamide

Systemtic Name: 2-[[4-cyano-3-(trifluoromethyl)phenyl]-[2,2,2-tris(fluoranyl)ethyl]amino]-N-ethyl-butanamide Openeye Name: 2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]-N-ethyl-butanamide CAS Name: 2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]-N-ethylbutanamide IUPAC Name: 2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]-N-ethylbutanamide Traditional Name: 2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]-N-ethyl-butyramide Formula: C16H17F6N3O MolecularWeight: 381.316099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17F6N3O/c1-3-13(14(26)24-4-2)25(9-15(17,18)19)11-6-5-10(8-23)12(7-11)16(20,21)22/h5-7,13H,3-4,9H2,1-2H3,(H,24,26)