[4-[[3-(trifluoromethyl)phenyl]iminomethyl]phenyl] 4-nitrobenzoate

Systemtic Name: [4-[[3-(trifluoromethyl)phenyl]iminomethyl]phenyl] 4-nitrobenzoate Openeye Name: [4-[[3-(trifluoromethyl)phenyl]iminomethyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[[3-(trifluoromethyl)phenyl]iminomethyl]phenyl] ester IUPAC Name: [4-[[3-(trifluoromethyl)phenyl]iminomethyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[[3-(trifluoromethyl)phenyl]iminomethyl]phenyl] ester Formula: C21H13F3N2O4 MolecularWeight: 414.33413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C21H13F3N2O4/c22-21(23,24)16-2-1-3-17(12-16)25-13-14-4-10-19(11-5-14)30-20(27)15-6-8-18(9-7-15)26(28)29/h1-13H