1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-1-ium-4-amine

Systemtic Name: 1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-1-ium-4-amine Openeye Name: 1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-1-ium-4-amine CAS Name: 1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-1-ium-4-amine IUPAC Name: 1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-1-ium-4-amine Traditional Name: (1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-1-ium-4-yl)amine Formula: C11H10N5+ MolecularWeight: 212.2306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C3C(=CN2)C(=NC=N3)N

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C3C(=CN2)C(=NC=N3)N

InChI

InChI=1S/C11H9N5/c12-10-9-6-15-16(11(9)14-7-13-10)8-4-2-1-3-5-8/h1-7H,(H2,12,13,14,15)/p+1