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

Systemtic Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pentanamide Openeye Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pentanamide CAS Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pentanamide IUPAC Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)pentanamide Traditional Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)valeramide Formula: C16H23N4O+ MolecularWeight: 287.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)N3CC[NH+](CC3=N2)C

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)N3CC[NH+](CC3=N2)C

InChI

InChI=1S/C16H22N4O/c1-3-4-5-16(21)17-12-6-7-14-13(10-12)18-15-11-19(2)8-9-20(14)15/h6-7,10H,3-5,8-9,11H2,1-2H3,(H,17,21)/p+1