ethyl 3-nitro-5-[[2-(trifluoromethyloxy)phenyl]methylcarbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[2-(trifluoromethyloxy)phenyl]methylcarbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[2-(trifluoromethoxy)phenyl]methylcarbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[[2-(trifluoromethoxy)phenyl]methylamino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[2-(trifluoromethoxy)phenyl]methylcarbamoyl]benzoate Traditional Name: 3-nitro-5-[[2-(trifluoromethoxy)benzyl]carbamoyl]benzoic acid ethyl ester Formula: C18H15F3N2O6 MolecularWeight: 412.31671

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=CC=C2OC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC=CC=C2OC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15F3N2O6/c1-2-28-17(25)13-7-12(8-14(9-13)23(26)27)16(24)22-10-11-5-3-4-6-15(11)29-18(19,20)21/h3-9H,2,10H2,1H3,(H,22,24)