2-methoxy-[1,2,4]triazino[3,2-a]isoquinolin-5-ium perchlorate

Systemtic Name: 2-methoxy-[1,2,4]triazino[3,2-a]isoquinolin-5-ium perchlorate Openeye Name: 2-methoxy-[1,2,4]triazino[3,2-a]isoquinolin-5-ium perchlorate CAS Name: 2-methoxy-[1,2,4]triazino[3,2-a]isoquinolin-5-ium perchlorate IUPAC Name: 2-methoxy-[1,2,4]triazino[3,2-a]isoquinolin-5-ium perchlorate Traditional Name: 2-methoxy-[1,2,4]triazin[3,2-a]isoquinolin-5-ium perchlorate Formula: C12H10ClN3O5 MolecularWeight: 311.6779

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=[N+]2C=CC3=CC=CC=C3C2=N1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CN=[N+]2C=CC3=CC=CC=C3C2=N1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H10N3O.ClHO4/c1-16-11-8-13-15-7-6-9-4-2-3-5-10(9)12(15)14-11;2-1(3,4)5/h2-8H,1H3;(H,2,3,4,5)/q+1;/p-1