copper 2-(1H-imidazol-2-yl)quinazolin-4-amine dinitrate

Systemtic Name: copper 2-(1H-imidazol-2-yl)quinazolin-4-amine dinitrate Openeye Name: copper 2-(1H-imidazol-2-yl)quinazolin-4-amine dinitrate CAS Name: copper 2-(1H-imidazol-2-yl)-4-quinazolinamine dinitrate IUPAC Name: copper 2-(1H-imidazol-2-yl)quinazolin-4-amine dinitrate Traditional Name: cupric [2-(1H-imidazol-2-yl)quinazolin-4-yl]amine dinitrate Formula: C22H18CuN12O6 MolecularWeight: 610.00112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=NC=CN3)N.C1=CC=C2C(=C1)C(=NC(=N2)C3=NC=CN3)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=NC=CN3)N.C1=CC=C2C(=C1)C(=NC(=N2)C3=NC=CN3)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

InChI

InChI=1S/2C11H9N5.Cu.2NO3/c2*12-9-7-3-1-2-4-8(7)15-11(16-9)10-13-5-6-14-10;;2*2-1(3)4/h2*1-6H,(H,13,14)(H2,12,15,16);;;/q;;+2;2*-1