2-tert-butyl-3-(3-chloranylpropyl)-4H-imidazo[1,2-a]benzimidazol-9-ium chloride

Systemtic Name: 2-tert-butyl-3-(3-chloranylpropyl)-4H-imidazo[1,2-a]benzimidazol-9-ium chloride Openeye Name: 2-tert-butyl-3-(3-chloropropyl)-4H-imidazo[1,2-a]benzimidazol-9-ium chloride CAS Name: 2-tert-butyl-3-(3-chloropropyl)-4H-imidazo[1,2-a]benzimidazol-9-ium chloride IUPAC Name: 2-tert-butyl-3-(3-chloropropyl)-4H-imidazo[1,2-a]benzimidazol-9-ium chloride Traditional Name: 2-tert-butyl-3-(3-chloropropyl)-4H-imidazo[1,2-a]benzimidazol-9-ium chloride Formula: C16H21Cl2N3 MolecularWeight: 326.26404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C[N+]2=C(N1CCCCl)NC3=CC=CC=C32.[Cl-]

Isomeric SMILES

CC(C)(C)C1=C[N+]2=C(N1CCCCl)NC3=CC=CC=C32.[Cl-]

InChI

InChI=1S/C16H20ClN3.ClH/c1-16(2,3)14-11-20-13-8-5-4-7-12(13)18-15(20)19(14)10-6-9-17;/h4-5,7-8,11H,6,9-10H2,1-3H3;1H