[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl] 2-azanyl-4-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl] 2-azanyl-4-nitro-benzoate Openeye Name: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-amino-4-nitro-benzoate CAS Name: 2-amino-4-nitrobenzoic acid [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-amino-4-nitrobenzoate Traditional Name: 2-amino-4-nitro-benzoic acid [2-keto-2-[2-(trifluoromethyl)anilino]ethyl] ester Formula: C16H12F3N3O5 MolecularWeight: 383.27879

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)COC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C16H12F3N3O5/c17-16(18,19)11-3-1-2-4-13(11)21-14(23)8-27-15(24)10-6-5-9(22(25)26)7-12(10)20/h1-7H,8,20H2,(H,21,23)