[1-oxidanylidene-1-[2,2,2-tris(fluoranyl)ethylamino]propan-2-yl] 2-ethoxypyridine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[2,2,2-tris(fluoranyl)ethylamino]propan-2-yl] 2-ethoxypyridine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [1-oxo-1-(2,2,2-trifluoroethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,2,2-trifluoroethylamino)propan-2-yl] 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [2-keto-1-methyl-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C13H15F3N2O4 MolecularWeight: 320.26441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OC(C)C(=O)NCC(F)(F)F

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OC(C)C(=O)NCC(F)(F)F

InChI

InChI=1S/C13H15F3N2O4/c1-3-21-11-9(5-4-6-17-11)12(20)22-8(2)10(19)18-7-13(14,15)16/h4-6,8H,3,7H2,1-2H3,(H,18,19)