[2-oxidanylidene-1-phenyl-2-[2,2,2-tris(fluoranyl)ethoxy]ethyl] 4-nitrobenzoate

Systemtic Name: [2-oxidanylidene-1-phenyl-2-[2,2,2-tris(fluoranyl)ethoxy]ethyl] 4-nitrobenzoate Openeye Name: [2-oxo-1-phenyl-2-(2,2,2-trifluoroethoxy)ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-oxo-1-phenyl-2-(2,2,2-trifluoroethoxy)ethyl] ester IUPAC Name: [2-oxo-1-phenyl-2-(2,2,2-trifluoroethoxy)ethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-keto-1-phenyl-2-(2,2,2-trifluoroethoxy)ethyl] ester Formula: C17H12F3NO6 MolecularWeight: 383.27549

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12F3NO6/c18-17(19,20)10-26-16(23)14(11-4-2-1-3-5-11)27-15(22)12-6-8-13(9-7-12)21(24)25/h1-9,14H,10H2