2-[bis(azanyl)methylidene]-3,5-diphenyl-4H-pyrazol-2-ium-3-ol nitrate

Systemtic Name: 2-[bis(azanyl)methylidene]-3,5-diphenyl-4H-pyrazol-2-ium-3-ol nitrate Openeye Name: 2-(diaminomethylene)-3,5-diphenyl-4H-pyrazol-2-ium-3-ol nitrate CAS Name: 2-(diaminomethylidene)-3,5-diphenyl-4H-pyrazol-2-ium-3-ol nitrate IUPAC Name: 2-(diaminomethylidene)-3,5-diphenyl-4H-pyrazol-2-ium-3-ol nitrate Traditional Name: 2-(diaminomethylene)-3,5-diphenyl-2-pyrazolin-2-ium-3-ol nitrate Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=N[N+](=C(N)N)C1(C2=CC=CC=C2)O)C3=CC=CC=C3.[N+](=O)([O-])[O-]

Isomeric SMILES

C1C(=N[N+](=C(N)N)C1(C2=CC=CC=C2)O)C3=CC=CC=C3.[N+](=O)([O-])[O-]

InChI

InChI=1S/C16H16N4O.NO3/c17-15(18)20-16(21,13-9-5-2-6-10-13)11-14(19-20)12-7-3-1-4-8-12;2-1(3)4/h1-10,21H,11H2,(H3,17,18);/q;-1/p+1