ethyl 2,4-dimethyl-5-[2,2,2-tris(fluoranyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2,2,2-tris(fluoranyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-(2,2,2-trifluoroethylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(2,2,2-trifluoroethylamino)methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-(2,2,2-trifluoroethylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(2,2,2-trifluoroethylcarbamoyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C12H15F3N2O3 MolecularWeight: 292.25431

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC(F)(F)F)C

InChI

InChI=1S/C12H15F3N2O3/c1-4-20-11(19)8-6(2)9(17-7(8)3)10(18)16-5-12(13,14)15/h17H,4-5H2,1-3H3,(H,16,18)