2,5-bis(hydroxymethyl)-1H-pyrazolo[3,4-d]pyrimidin-5-ium-4-one

Systemtic Name: 2,5-bis(hydroxymethyl)-1H-pyrazolo[3,4-d]pyrimidin-5-ium-4-one Openeye Name: 2,5-bis(hydroxymethyl)-1H-pyrazolo[3,4-d]pyrimidin-5-ium-4-one CAS Name: 2,5-bis(hydroxymethyl)-1H-pyrazolo[3,4-d]pyrimidin-5-ium-4-one IUPAC Name: 2,5-bis(hydroxymethyl)-1H-pyrazolo[3,4-d]pyrimidin-5-ium-4-one Traditional Name: 2,5-dimethylol-1H-pyrazolo[3,4-d]pyrimidin-5-ium-4-one Formula: C7H9N4O3+ MolecularWeight: 197.17136

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=[N+](C2=O)CO)NN1CO

Isomeric SMILES

C1=C2C(=NC=[N+](C2=O)CO)NN1CO

InChI

InChI=1S/C7H8N4O3/c12-3-10-2-8-6-5(7(10)14)1-11(4-13)9-6/h1-2,12-13H,3-4H2/p+1