ethyl 5-[bis(fluoranyl)methyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 5-[bis(fluoranyl)methyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 5-(difluoromethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5-(difluoromethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(difluoromethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 5-(difluoromethyl)-7-keto-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C10H9F2N3O3 MolecularWeight: 257.193566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN2C1=NC(=CC2=O)C(F)F

Isomeric SMILES

CCOC(=O)C1=CNN2C1=NC(=CC2=O)C(F)F

InChI

InChI=1S/C10H9F2N3O3/c1-2-18-10(17)5-4-13-15-7(16)3-6(8(11)12)14-9(5)15/h3-4,8,13H,2H2,1H3