ethyl 3-(furan-2-ylcarbonyl)-5-methyl-2-oxidanyl-1-(phenylcarbamoylamino)-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate

Systemtic Name: ethyl 3-(furan-2-ylcarbonyl)-5-methyl-2-oxidanyl-1-(phenylcarbamoylamino)-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate Openeye Name: ethyl 3-(furan-2-carbonyl)-2-hydroxy-5-methyl-1-(phenylcarbamoylamino)-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate CAS Name: 1-[[anilino(oxo)methyl]amino]-3-[2-furanyl(oxo)methyl]-2-hydroxy-5-methyl-2-(trifluoromethyl)-3H-pyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(furan-2-carbonyl)-2-hydroxy-5-methyl-1-(phenylcarbamoylamino)-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate Traditional Name: 4-(2-furoyl)-5-hydroxy-2-methyl-1-(phenylcarbamoylamino)-5-(trifluoromethyl)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C21H20F3N3O6 MolecularWeight: 467.39521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(C1C(=O)C2=CC=CO2)(C(F)(F)F)O)NC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(C1C(=O)C2=CC=CO2)(C(F)(F)F)O)NC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H20F3N3O6/c1-3-32-18(29)15-12(2)27(26-19(30)25-13-8-5-4-6-9-13)20(31,21(22,23)24)16(15)17(28)14-10-7-11-33-14/h4-11,16,31H,3H2,1-2H3,(H2,25,26,30)