[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H12F3N3O4 MolecularWeight: 379.29009

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H12F3N3O4/c1-9(24)11-6-13(21-7-11)16(25)26-8-14-22-15(23-27-14)10-3-2-4-12(5-10)17(18,19)20/h2-7,21H,8H2,1H3