ethyl 5-(2,2-dimethylpropyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 5-(2,2-dimethylpropyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 5-(2,2-dimethylpropyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5-(2,2-dimethylpropyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,2-dimethylpropyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-keto-5-neopentyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C14H19N3O3 MolecularWeight: 277.31896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O3/c1-5-20-13(19)10-8-15-17-11(18)6-9(16-12(10)17)7-14(2,3)4/h6,8,15H,5,7H2,1-4H3