ethyl 6-butyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 6-butyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 6-butyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-butyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-butyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-butyl-7-keto-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C2C(=CNN2C1=O)C(=O)OCC

Isomeric SMILES

CCCCC1=CN=C2C(=CNN2C1=O)C(=O)OCC

InChI

InChI=1S/C13H17N3O3/c1-3-5-6-9-7-14-11-10(13(18)19-4-2)8-15-16(11)12(9)17/h7-8,15H,3-6H2,1-2H3