1-(2-hydroxyethyl)-3-nitro-pyrazolo[3,4-d]pyrimidin-4-olate

Systemtic Name: 1-(2-hydroxyethyl)-3-nitro-pyrazolo[3,4-d]pyrimidin-4-olate Openeye Name: 1-(2-hydroxyethyl)-3-nitro-pyrazolo[3,4-d]pyrimidin-4-olate CAS Name: 1-(2-hydroxyethyl)-3-nitro-4-pyrazolo[3,4-d]pyrimidinolate IUPAC Name: 1-(2-hydroxyethyl)-3-nitropyrazolo[3,4-d]pyrimidin-4-olate Traditional Name: 1-(2-hydroxyethyl)-3-nitro-pyrazolo[3,4-d]pyrimidin-4-olate Formula: C7H6N5O4- MolecularWeight: 224.15364

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=NN2CCO)[N+](=O)[O-])C(=N1)[O-]

Isomeric SMILES

C1=NC2=C(C(=NN2CCO)[N+](=O)[O-])C(=N1)[O-]

InChI

InChI=1S/C7H7N5O4/c13-2-1-11-5-4(6(10-11)12(15)16)7(14)9-3-8-5/h3,13H,1-2H2,(H,8,9,14)/p-1