2-(1,3-benzodioxol-5-yl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium CAS Name: 2-(1,3-benzodioxol-5-yl)-4-[2-(1-pyrrolidin-1-iumyl)ethyl]-3H-imidazo[1,2-a]benzimidazol-4-ium IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(2-pyrrolidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium Formula: C22H24N4O2+2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC[N+]2=C3NC(=CN3C4=CC=CC=C42)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CC[NH+](C1)CC[N+]2=C3NC(=CN3C4=CC=CC=C42)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C22H22N4O2/c1-2-6-19-18(5-1)25(12-11-24-9-3-4-10-24)22-23-17(14-26(19)22)16-7-8-20-21(13-16)28-15-27-20/h1-2,5-8,13-14H,3-4,9-12,15H2/p+2