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

Systemtic Name: (4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 4-(diethylamino)-4-oxidanylidene-butanoate Openeye Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 4-(diethylamino)-4-oxo-butanoate CAS Name: 4-(diethylamino)-4-oxobutanoic acid (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester IUPAC Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 4-(diethylamino)-4-oxobutanoate Traditional Name: 4-(diethylamino)-4-keto-butyric acid (4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester Formula: C14H19N5O4 MolecularWeight: 321.33176

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCC(=O)OCN1C2=NC=NC(=O)C2=CN1

Isomeric SMILES

CCN(CC)C(=O)CCC(=O)OCN1C2=NC=NC(=O)C2=CN1

InChI

InChI=1S/C14H19N5O4/c1-3-18(4-2)11(20)5-6-12(21)23-9-19-13-10(7-17-19)14(22)16-8-15-13/h7-8,17H,3-6,9H2,1-2H3