methyl 5-oxidanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: methyl 5-oxidanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: methyl 5-oxo-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 5-oxo-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 5-keto-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid methyl ester Formula: C9H6F3N3O3 MolecularWeight: 261.15745

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=NC(=O)C=C(N2N1)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2=NC(=O)C=C(N2N1)C(F)(F)F

InChI

InChI=1S/C9H6F3N3O3/c1-18-8(17)4-2-6-13-7(16)3-5(9(10,11)12)15(6)14-4/h2-3,14H,1H3