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

Systemtic Name: ethyl 7-oxidanylidene-2-(4-phenylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 7-oxo-2-(4-phenylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-oxo-2-(4-phenylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-oxo-2-(4-phenylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-keto-2-(4-phenylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(NN2C1=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(NN2C1=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O3/c1-2-27-21(26)17-13-22-19-12-18(23-24(19)20(17)25)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-13,23H,2H2,1H3