N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pyridine-3-carboxamide

Systemtic Name: N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pyridine-3-carboxamide Openeye Name: N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pyridine-3-carboxamide CAS Name: N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-pyridinecarboxamide IUPAC Name: N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pyridine-3-carboxamide Traditional Name: N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)nicotinamide Formula: C21H24N5O+ MolecularWeight: 362.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN3C(=NC4=C3C=CC(=C4)NC(=O)C5=CN=CC=C5)C2

Isomeric SMILES

C1CCC(C1)[NH+]2CCN3C(=NC4=C3C=CC(=C4)NC(=O)C5=CN=CC=C5)C2

InChI

InChI=1S/C21H23N5O/c27-21(15-4-3-9-22-13-15)23-16-7-8-19-18(12-16)24-20-14-25(10-11-26(19)20)17-5-1-2-6-17/h3-4,7-9,12-13,17H,1-2,5-6,10-11,14H2,(H,23,27)/p+1