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

Systemtic Name: 3-bromanyl-N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Openeye Name: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide CAS Name: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide IUPAC Name: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Traditional Name: 3-bromo-N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Formula: C18H18BrN4O+ MolecularWeight: 386.26572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN4O/c1-22-7-8-23-16-6-5-14(10-15(16)21-17(23)11-22)20-18(24)12-3-2-4-13(19)9-12/h2-6,9-10H,7-8,11H2,1H3,(H,20,24)/p+1