2-(phenylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-carboxamide

Systemtic Name: 2-(phenylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-carboxamide Openeye Name: 2-benzyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-carboxamide CAS Name: 2-(phenylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-carboxamide IUPAC Name: 2-benzyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-carboxamide Traditional Name: 2-benzyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-carboxamide Formula: C18H19N4O+ MolecularWeight: 307.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=NC3=C2C=CC(=C3)C(=O)N)C[NH+]1CC4=CC=CC=C4

Isomeric SMILES

C1CN2C(=NC3=C2C=CC(=C3)C(=O)N)C[NH+]1CC4=CC=CC=C4

InChI

InChI=1S/C18H18N4O/c19-18(23)14-6-7-16-15(10-14)20-17-12-21(8-9-22(16)17)11-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2,(H2,19,23)/p+1