[2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-chloranyl-2-nitro-benzoate

Systemtic Name: [2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-chloranyl-2-nitro-benzoate Openeye Name: [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 4-chloro-2-nitro-benzoate CAS Name: 4-chloro-2-nitrobenzoic acid [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 4-chloro-2-nitrobenzoate Traditional Name: 4-chloro-2-nitro-benzoic acid [2-keto-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C22H14ClF3N2O5 MolecularWeight: 478.80517

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)OC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)OC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H14ClF3N2O5/c23-15-9-10-17(18(12-15)28(31)32)21(30)33-19(13-5-2-1-3-6-13)20(29)27-16-8-4-7-14(11-16)22(24,25)26/h1-12,19H,(H,27,29)