copper 3-(1-methylimidazol-2-yl)isoquinolin-1-amine dinitrate

Systemtic Name: copper 3-(1-methylimidazol-2-yl)isoquinolin-1-amine dinitrate Openeye Name: copper 3-(1-methylimidazol-2-yl)isoquinolin-1-amine dinitrate CAS Name: copper 3-(1-methyl-2-imidazolyl)-1-isoquinolinamine dinitrate IUPAC Name: copper 3-(1-methylimidazol-2-yl)isoquinolin-1-amine dinitrate Traditional Name: cupric [3-(1-methylimidazol-2-yl)-1-isoquinolyl]amine dinitrate Formula: C26H24CuN10O6 MolecularWeight: 636.07816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=CC3=CC=CC=C3C(=N2)N.CN1C=CN=C1C2=CC3=CC=CC=C3C(=N2)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

Isomeric SMILES

CN1C=CN=C1C2=CC3=CC=CC=C3C(=N2)N.CN1C=CN=C1C2=CC3=CC=CC=C3C(=N2)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

InChI

InChI=1S/2C13H12N4.Cu.2NO3/c2*1-17-7-6-15-13(17)11-8-9-4-2-3-5-10(9)12(14)16-11;;2*2-1(3)4/h2*2-8H,1H3,(H2,14,16);;;/q;;+2;2*-1