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

Systemtic Name: 3-methyl-3-nitroso-1-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)pentane-2,4-dione Openeye Name: 3-methyl-3-nitroso-1-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)pentane-2,4-dione CAS Name: 3-methyl-3-nitroso-1-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)pentane-2,4-dione IUPAC Name: 3-methyl-3-nitroso-1-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)pentane-2,4-dione Traditional Name: 1-(4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)-3-methyl-3-nitroso-pentane-2,4-dione Formula: C11H11N5O4 MolecularWeight: 277.23614

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C(=O)CN1C2=NC=NC(=O)C2=CN1)N=O

Isomeric SMILES

CC(=O)C(C)(C(=O)CN1C2=NC=NC(=O)C2=CN1)N=O

InChI

InChI=1S/C11H11N5O4/c1-6(17)11(2,15-20)8(18)4-16-9-7(3-14-16)10(19)13-5-12-9/h3,5,14H,4H2,1-2H3