6-(azaniumylmethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-olate

Systemtic Name: 6-(azaniumylmethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-olate Openeye Name: 6-(azaniumylmethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-olate CAS Name: 6-(ammoniomethyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinolate IUPAC Name: 6-(azaniumylmethyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-olate Traditional Name: 6-(ammoniomethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-olate Formula: C12H11N5O MolecularWeight: 241.24864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)C[NH3+])[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)C[NH3+])[O-]

InChI

InChI=1S/C12H11N5O/c13-6-10-15-11-9(12(18)16-10)7-14-17(11)8-4-2-1-3-5-8/h1-5,7H,6,13H2,(H,15,16,18)