[2,2,2-tris(fluoranyl)-1-phenyl-ethyl] 3-nitrobenzoate

Systemtic Name: [2,2,2-tris(fluoranyl)-1-phenyl-ethyl] 3-nitrobenzoate Openeye Name: (2,2,2-trifluoro-1-phenyl-ethyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2,2,2-trifluoro-1-phenylethyl) ester IUPAC Name: (2,2,2-trifluoro-1-phenylethyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2,2,2-trifluoro-1-phenyl-ethyl) ester Formula: C15H10F3NO4 MolecularWeight: 325.23941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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