ethyl 3-[[4,4,4-tris(fluoranyl)-3-oxidanyl-1-[3-(trifluoromethyl)phenyl]butyl]amino]benzoate

Systemtic Name: ethyl 3-[[4,4,4-tris(fluoranyl)-3-oxidanyl-1-[3-(trifluoromethyl)phenyl]butyl]amino]benzoate Openeye Name: ethyl 3-[[4,4,4-trifluoro-3-hydroxy-1-[3-(trifluoromethyl)phenyl]butyl]amino]benzoate CAS Name: 3-[[4,4,4-trifluoro-3-hydroxy-1-[3-(trifluoromethyl)phenyl]butyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4,4,4-trifluoro-3-hydroxy-1-[3-(trifluoromethyl)phenyl]butyl]amino]benzoate Traditional Name: 3-[[4,4,4-trifluoro-3-hydroxy-1-[3-(trifluoromethyl)phenyl]butyl]amino]benzoic acid ethyl ester Formula: C20H19F6NO3 MolecularWeight: 435.360179

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(CC(C(F)(F)F)O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(CC(C(F)(F)F)O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C20H19F6NO3/c1-2-30-18(29)13-6-4-8-15(10-13)27-16(11-17(28)20(24,25)26)12-5-3-7-14(9-12)19(21,22)23/h3-10,16-17,27-28H,2,11H2,1H3