tert-butyl 2-[[5-fluoranyl-2-nitro-4-(trifluoromethyl)phenyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[[5-fluoranyl-2-nitro-4-(trifluoromethyl)phenyl]amino]ethanoate Openeye Name: tert-butyl 2-[5-fluoro-2-nitro-4-(trifluoromethyl)anilino]acetate CAS Name: 2-[5-fluoro-2-nitro-4-(trifluoromethyl)anilino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-fluoro-2-nitro-4-(trifluoromethyl)anilino]acetate Traditional Name: 2-[5-fluoro-2-nitro-4-(trifluoromethyl)anilino]acetic acid tert-butyl ester Formula: C13H14F4N2O4 MolecularWeight: 338.254873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC1=C(C=C(C(=C1)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CNC1=C(C=C(C(=C1)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H14F4N2O4/c1-12(2,3)23-11(20)6-18-9-5-8(14)7(13(15,16)17)4-10(9)19(21)22/h4-5,18H,6H2,1-3H3