9-methyl-6-pyridin-1-ium-1-yl-purine perchlorate

Systemtic Name: 9-methyl-6-pyridin-1-ium-1-yl-purine perchlorate Openeye Name: 9-methyl-6-pyridin-1-ium-1-yl-purine perchlorate CAS Name: 9-methyl-6-(1-pyridin-1-iumyl)purine perchlorate IUPAC Name: 9-methyl-6-pyridin-1-ium-1-ylpurine perchlorate Traditional Name: 9-methyl-6-pyridin-1-ium-1-yl-purine perchlorate Formula: C11H10ClN5O4 MolecularWeight: 311.6812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2[N+]3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN1C=NC2=C1N=CN=C2[N+]3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H10N5.ClHO4/c1-15-8-14-9-10(15)12-7-13-11(9)16-5-3-2-4-6-16;2-1(3,4)5/h2-8H,1H3;(H,2,3,4,5)/q+1;/p-1