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

Systemtic Name: [2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 3-methyl-4-nitro-benzoate Openeye Name: [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-keto-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C23H17F3N2O5 MolecularWeight: 458.38669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H17F3N2O5/c1-14-12-16(10-11-19(14)28(31)32)22(30)33-20(15-6-3-2-4-7-15)21(29)27-18-9-5-8-17(13-18)23(24,25)26/h2-13,20H,1H3,(H,27,29)