ethyl 2-(4-cyanophenyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-(4-cyanophenyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 2-(4-cyanophenyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 2-(4-cyanophenyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-cyanophenyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 2-(4-cyanophenyl)-7-keto-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(NN2C1=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(NN2C1=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N4O3/c1-2-23-16(22)12-9-18-14-7-13(19-20(14)15(12)21)11-5-3-10(8-17)4-6-11/h3-7,9,19H,2H2,1H3