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

Systemtic Name: 3-bromanyl-N-(2-ethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Openeye Name: 3-bromo-N-(2-ethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide CAS Name: 3-bromo-N-(2-ethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide IUPAC Name: 3-bromo-N-(2-ethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Traditional Name: 3-bromo-N-(2-ethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Formula: C19H20BrN4O+ MolecularWeight: 400.2923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN4O/c1-2-23-8-9-24-17-7-6-15(11-16(17)22-18(24)12-23)21-19(25)13-4-3-5-14(20)10-13/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,25)/p+1