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

Systemtic Name: 2-chloranyl-N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Openeye Name: 2-chloro-N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide CAS Name: 2-chloro-N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide IUPAC Name: 2-chloro-N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Traditional Name: 2-chloro-N-(2-cyclopentyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Formula: C22H24ClN4O+ MolecularWeight: 395.90516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN3C(=NC4=C3C=CC(=C4)NC(=O)C5=CC=CC=C5Cl)C2

Isomeric SMILES

C1CCC(C1)[NH+]2CCN3C(=NC4=C3C=CC(=C4)NC(=O)C5=CC=CC=C5Cl)C2

InChI

InChI=1S/C22H23ClN4O/c23-18-8-4-3-7-17(18)22(28)24-15-9-10-20-19(13-15)25-21-14-26(11-12-27(20)21)16-5-1-2-6-16/h3-4,7-10,13,16H,1-2,5-6,11-12,14H2,(H,24,28)/p+1