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

Systemtic Name: N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)propanamide Openeye Name: N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)propanamide CAS Name: N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)propanamide IUPAC Name: N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)propanamide Traditional Name: N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)propionamide Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N3CC[NH+](CC3=N2)CCC4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N3CC[NH+](CC3=N2)CCC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O/c1-2-21(26)22-17-8-9-19-18(14-17)23-20-15-24(12-13-25(19)20)11-10-16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3,(H,22,26)/p+1