(4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl 2,2-dimethylpropanoate

Systemtic Name: (4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl 2,2-dimethylpropanoate Openeye Name: (4-oxo-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (4-oxo-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (4-keto-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl ester Formula: C11H14N4O3 MolecularWeight: 250.25386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=C2C(=NC=NC2=O)N1

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=C2C(=NC=NC2=O)N1

InChI

InChI=1S/C11H14N4O3/c1-11(2,3)10(17)18-6-15-4-7-8(14-15)12-5-13-9(7)16/h4-5H,6H2,1-3H3,(H,12,13,14,16)