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

Systemtic Name: (4-oxidanylidene-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl butanoate Openeye Name: (4-oxo-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl butanoate CAS Name: butanoic 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 butanoate Traditional Name: butyric acid (4-keto-1H-pyrazolo[3,4-d]pyrimidin-2-yl)methyl ester Formula: C10H12N4O3 MolecularWeight: 236.22728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCN1C=C2C(=NC=NC2=O)N1

Isomeric SMILES

CCCC(=O)OCN1C=C2C(=NC=NC2=O)N1

InChI

InChI=1S/C10H12N4O3/c1-2-3-8(15)17-6-14-4-7-9(13-14)11-5-12-10(7)16/h4-5H,2-3,6H2,1H3,(H,11,12,13,16)