[3-(trifluoromethyl)phenyl]methyl 3,5-dinitrobenzoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 3,5-dinitrobenzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-(trifluoromethyl)benzyl] ester Formula: C15H9F3N2O6 MolecularWeight: 370.23697

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9F3N2O6/c16-15(17,18)11-3-1-2-9(4-11)8-26-14(21)10-5-12(19(22)23)7-13(6-10)20(24)25/h1-7H,8H2