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

Systemtic Name: methyl 2,4-dimethyl-5-[2,2,2-tris(fluoranyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C11H13F3N2O3 MolecularWeight: 278.22773

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCC(F)(F)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCC(F)(F)F

InChI

InChI=1S/C11H13F3N2O3/c1-5-7(10(18)19-3)6(2)16-8(5)9(17)15-4-11(12,13)14/h16H,4H2,1-3H3,(H,15,17)