[2-nitro-6-(trifluoromethyl)phenyl]methyl benzoate

Systemtic Name: [2-nitro-6-(trifluoromethyl)phenyl]methyl benzoate Openeye Name: [2-nitro-6-(trifluoromethyl)phenyl]methyl benzoate CAS Name: benzoic acid [2-nitro-6-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-nitro-6-(trifluoromethyl)phenyl]methyl benzoate Traditional Name: benzoic acid [2-nitro-6-(trifluoromethyl)benzyl] ester Formula: C15H10F3NO4 MolecularWeight: 325.23941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10F3NO4/c16-15(17,18)12-7-4-8-13(19(21)22)11(12)9-23-14(20)10-5-2-1-3-6-10/h1-8H,9H2