trioxidanium; copper(1+); nitric acid; 1,3,7-trimethylpurine-2,6-dione

Systemtic Name: trioxidanium; copper(1+); nitric acid; 1,3,7-trimethylpurine-2,6-dione Openeye Name: cuprous; trioxonium; nitric acid; 1,3,7-trimethylpurine-2,6-dione CAS Name: trioxonium; copper(1+); nitric acid; 1,3,7-trimethylpurine-2,6-dione IUPAC Name: trioxidanium; copper(1+); nitric acid; 1,3,7-trimethylpurine-2,6-dione Traditional Name: cuprous; trioxonium; caffeine; nitric acid Formula: C8H20CuN5O8+4 MolecularWeight: 377.8191

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)C.[N+](=O)(O)[O-].[OH3+].[OH3+].[OH3+].[Cu+]

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)C.[N+](=O)(O)[O-].[OH3+].[OH3+].[OH3+].[Cu+]

InChI

InChI=1S/C8H10N4O2.Cu.HNO3.3H2O/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;;2-1(3)4;;;/h4H,1-3H3;;(H,2,3,4);3*1H2/q;+1;;;;/p+3