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

Systemtic Name: 3-methyl-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)butanamide Openeye Name: 3-methyl-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)butanamide CAS Name: 3-methyl-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)butanamide IUPAC Name: 3-methyl-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)butanamide Traditional Name: 3-methyl-N-(2-propyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)butyramide Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O/c1-4-7-21-8-9-22-16-6-5-14(19-18(23)10-13(2)3)11-15(16)20-17(22)12-21/h5-6,11,13H,4,7-10,12H2,1-3H3,(H,19,23)/p+1