1-methyl-1-[2-methyl-4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-2-propyl-4-pyridin-2-yl-benzimidazol-1-ium

Systemtic Name: 1-methyl-1-[2-methyl-4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-2-propyl-4-pyridin-2-yl-benzimidazol-1-ium Openeye Name: 1-methyl-1-[2-methyl-4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-2-propyl-4-(2-pyridyl)benzimidazol-1-ium CAS Name: 1-methyl-1-[2-methyl-4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-2-propyl-4-(2-pyridinyl)benzimidazol-1-ium IUPAC Name: 1-methyl-1-[2-methyl-4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-2-propyl-4-pyridin-2-ylbenzimidazol-1-ium Traditional Name: 1-methyl-1-[2-methyl-4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-2-propyl-4-(2-pyridyl)benzimidazol-1-ium Formula: C30H28N7+ MolecularWeight: 486.59022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC=C2[N+]1(C)C3=C(C(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5)C)C6=CC=CC=N6

Isomeric SMILES

CCCC1=NC2=C(C=CC=C2[N+]1(C)C3=C(C(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5)C)C6=CC=CC=N6

InChI

InChI=1S/C30H28N7/c1-4-11-27-32-29-23(24-15-8-9-19-31-24)14-10-16-26(29)37(27,3)25-18-17-22(21-12-6-5-7-13-21)28(20(25)2)30-33-35-36-34-30/h5-10,12-19H,4,11H2,1-3H3,(H,33,34,35,36)/q+1