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

Systemtic Name: N-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-methyl-butanamide Openeye Name: N-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-methyl-butanamide CAS Name: N-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-methylbutanamide IUPAC Name: N-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-methylbutanamide Traditional Name: N-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-methyl-butyramide Formula: C21H31N4O+ MolecularWeight: 355.49704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC2=C(C=C1)N3CC[NH+](CC3=N2)C4CCCCC4

Isomeric SMILES

CC(C)CC(=O)NC1=CC2=C(C=C1)N3CC[NH+](CC3=N2)C4CCCCC4

InChI

InChI=1S/C21H30N4O/c1-15(2)12-21(26)22-16-8-9-19-18(13-16)23-20-14-24(10-11-25(19)20)17-6-4-3-5-7-17/h8-9,13,15,17H,3-7,10-12,14H2,1-2H3,(H,22,26)/p+1