ethyl 3-(4-oxidanylidene-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoate

Systemtic Name: ethyl 3-(4-oxidanylidene-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoate Openeye Name: ethyl 3-[1-(1-ethylpropyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]propanoate CAS Name: 3-(4-oxo-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-oxo-1-pentan-3-yl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanoate Traditional Name: 3-[1-(1-ethylpropyl)-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl]propionic acid ethyl ester Formula: C15H22N4O3 MolecularWeight: 306.36018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C2=NC(=NC(=O)C2=CN1)CCC(=O)OCC

Isomeric SMILES

CCC(CC)N1C2=NC(=NC(=O)C2=CN1)CCC(=O)OCC

InChI

InChI=1S/C15H22N4O3/c1-4-10(5-2)19-14-11(9-16-19)15(21)18-12(17-14)7-8-13(20)22-6-3/h9-10,16H,4-8H2,1-3H3