(4-nitrophenyl)methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate

Systemtic Name: (4-nitrophenyl)methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate Openeye Name: (4-nitrophenyl)methyl 2-[3-(trifluoromethyl)anilino]benzoate CAS Name: 2-[3-(trifluoromethyl)anilino]benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[3-(trifluoromethyl)anilino]benzoate Traditional Name: 2-[3-(trifluoromethyl)anilino]benzoic acid (4-nitrobenzyl) ester Formula: C21H15F3N2O4 MolecularWeight: 416.35001

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H15F3N2O4/c22-21(23,24)15-4-3-5-16(12-15)25-19-7-2-1-6-18(19)20(27)30-13-14-8-10-17(11-9-14)26(28)29/h1-12,25H,13H2