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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-butyl-3H-imidazo[1,2-a]benzimidazol-4-ium Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-butyl-3H-imidazo[1,2-a]benzimidazol-4-ium CAS Name: 2-(1,3-benzodioxol-5-yl)-4-butyl-3H-imidazo[1,2-a]benzimidazol-4-ium IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-butyl-3H-imidazo[1,2-a]benzimidazol-4-ium Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-butyl-3H-imidazo[1,2-a]benzimidazol-4-ium Formula: C20H20N3O2+ MolecularWeight: 334.3917

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C2NC(=CN2C3=CC=CC=C31)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCC[N+]1=C2NC(=CN2C3=CC=CC=C31)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H19N3O2/c1-2-3-10-22-16-6-4-5-7-17(16)23-12-15(21-20(22)23)14-8-9-18-19(11-14)25-13-24-18/h4-9,11-12H,2-3,10,13H2,1H3/p+1