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

Systemtic Name: methyl 4-[[[4-cyano-3-(trifluoromethyl)phenyl]-[2,2,2-tris(fluoranyl)ethyl]amino]methyl]benzoate Openeye Name: methyl 4-[[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]methyl]benzoate CAS Name: 4-[[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]methyl]benzoate Traditional Name: 4-[[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]methyl]benzoic acid methyl ester Formula: C19H14F6N2O2 MolecularWeight: 416.317079

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(CC(F)(F)F)C2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(CC(F)(F)F)C2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C19H14F6N2O2/c1-29-17(28)13-4-2-12(3-5-13)10-27(11-18(20,21)22)15-7-6-14(9-26)16(8-15)19(23,24)25/h2-8H,10-11H2,1H3