[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 2-nitrobenzoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C11H9F3N2O5 MolecularWeight: 306.19477

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9F3N2O5/c12-11(13,14)6-15-9(17)5-21-10(18)7-3-1-2-4-8(7)16(19)20/h1-4H,5-6H2,(H,15,17)