[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylcarbamoylamino]ethyl] 1-methylpyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylcarbamoylamino]ethyl] 1-methylpyrrole-2-carboxylate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylcarbamoylamino)ethyl] 1-methylpyrrole-2-carboxylate CAS Name: 1-methyl-2-pyrrolecarboxylic acid [2-oxo-2-[[oxo-(2,2,2-trifluoroethylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylcarbamoylamino)ethyl] 1-methylpyrrole-2-carboxylate Traditional Name: 1-methylpyrrole-2-carboxylic acid [2-keto-2-(2,2,2-trifluoroethylcarbamoylamino)ethyl] ester Formula: C11H12F3N3O4 MolecularWeight: 307.22589

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)OCC(=O)NC(=O)NCC(F)(F)F

Isomeric SMILES

CN1C=CC=C1C(=O)OCC(=O)NC(=O)NCC(F)(F)F

InChI

InChI=1S/C11H12F3N3O4/c1-17-4-2-3-7(17)9(19)21-5-8(18)16-10(20)15-6-11(12,13)14/h2-4H,5-6H2,1H3,(H2,15,16,18,20)