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

Systemtic Name: 3-phenyl-[1,2,4]triazino[3,2-a]isoquinolin-5-ium Openeye Name: 3-phenyl-[1,2,4]triazino[3,2-a]isoquinolin-5-ium CAS Name: 3-phenyl-[1,2,4]triazino[3,2-a]isoquinolin-5-ium IUPAC Name: 3-phenyl-[1,2,4]triazino[3,2-a]isoquinolin-5-ium Traditional Name: 3-phenyl-[1,2,4]triazin[3,2-a]isoquinolin-5-ium Formula: C17H12N3+ MolecularWeight: 258.29728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C3C4=CC=CC=C4C=C[N+]3=N2

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C3C4=CC=CC=C4C=C[N+]3=N2

InChI

InChI=1S/C17H12N3/c1-2-7-14(8-3-1)16-12-18-17-15-9-5-4-6-13(15)10-11-20(17)19-16/h1-12H/q+1