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

Systemtic Name: 4-methoxy-N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Openeye Name: 4-methoxy-N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide CAS Name: 4-methoxy-N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide IUPAC Name: 4-methoxy-N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Traditional Name: 4-methoxy-N-(2-phenethyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)benzamide Formula: C26H27N4O2+ MolecularWeight: 427.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N4CC[NH+](CC4=N3)CCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N4CC[NH+](CC4=N3)CCC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2/c1-32-22-10-7-20(8-11-22)26(31)27-21-9-12-24-23(17-21)28-25-18-29(15-16-30(24)25)14-13-19-5-3-2-4-6-19/h2-12,17H,13-16,18H2,1H3,(H,27,31)/p+1