5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: 5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: 5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 5-(4-nitrophenyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylate IUPAC Name: 5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Formula: C14H6F3N4O4- MolecularWeight: 351.21705

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H7F3N4O4/c15-14(16,17)11-5-9(7-1-3-8(4-2-7)21(24)25)18-12-6-10(13(22)23)19-20(11)12/h1-6H,(H,22,23)/p-1