(4-propanoylphenyl) 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate

Systemtic Name: (4-propanoylphenyl) 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Openeye Name: (4-propanoylphenyl) 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate CAS Name: 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Traditional Name: 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid (4-propionylphenyl) ester Formula: C23H16F3NO6 MolecularWeight: 459.37145

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H16F3NO6/c1-2-20(28)14-3-8-18(9-4-14)33-22(29)15-5-10-17(11-6-15)32-21-12-7-16(23(24,25)26)13-19(21)27(30)31/h3-13H,2H2,1H3