3,4-dimethoxy-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide

Systemtic Name: 3,4-dimethoxy-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Openeye Name: 3,4-dimethoxy-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide CAS Name: 3,4-dimethoxy-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide IUPAC Name: 3,4-dimethoxy-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Traditional Name: 3,4-dimethoxy-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN2C(=NC3=C2C=CC(=C3)NC(=O)C4=CC(=C(C=C4)OC)OC)C1

Isomeric SMILES

CCC[NH+]1CCN2C(=NC3=C2C=CC(=C3)NC(=O)C4=CC(=C(C=C4)OC)OC)C1

InChI

InChI=1S/C22H26N4O3/c1-4-9-25-10-11-26-18-7-6-16(13-17(18)24-21(26)14-25)23-22(27)15-5-8-19(28-2)20(12-15)29-3/h5-8,12-13H,4,9-11,14H2,1-3H3,(H,23,27)/p+1