[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 2-chloranyl-5-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 2-chloranyl-5-nitro-benzoate Openeye Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [2-keto-2-[4-(trifluoromethoxy)anilino]ethyl] ester Formula: C16H10ClF3N2O6 MolecularWeight: 418.70861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)OC(F)(F)F

InChI

InChI=1S/C16H10ClF3N2O6/c17-13-6-3-10(22(25)26)7-12(13)15(24)27-8-14(23)21-9-1-4-11(5-2-9)28-16(18,19)20/h1-7H,8H2,(H,21,23)