copper 5-chloranyl-3-pyridin-2-yl-isoquinolin-1-amine dinitrate

Systemtic Name: copper 5-chloranyl-3-pyridin-2-yl-isoquinolin-1-amine dinitrate Openeye Name: copper 5-chloro-3-(2-pyridyl)isoquinolin-1-amine dinitrate CAS Name: copper 5-chloro-3-(2-pyridinyl)-1-isoquinolinamine dinitrate IUPAC Name: copper 5-chloro-3-pyridin-2-ylisoquinolin-1-amine dinitrate Traditional Name: cupric [5-chloro-3-(2-pyridyl)-1-isoquinolyl]amine dinitrate Formula: C14H10ClCuN5O6 MolecularWeight: 443.2581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC(=C3C=CC=C(C3=C2)Cl)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

Isomeric SMILES

C1=CC=NC(=C1)C2=NC(=C3C=CC=C(C3=C2)Cl)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

InChI

InChI=1S/C14H10ClN3.Cu.2NO3/c15-11-5-3-4-9-10(11)8-13(18-14(9)16)12-6-1-2-7-17-12;;2*2-1(3)4/h1-8H,(H2,16,18);;;/q;+2;2*-1