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

Systemtic Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-4-pyrrol-1-yl-benzamide Openeye Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-4-pyrrol-1-yl-benzamide CAS Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-4-(1-pyrrolyl)benzamide IUPAC Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-4-pyrrol-1-ylbenzamide Traditional Name: N-(2-methyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-4-pyrrol-1-yl-benzamide Formula: C22H22N5O+ MolecularWeight: 372.44298

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN2C(=NC3=C2C=CC(=C3)NC(=O)C4=CC=C(C=C4)N5C=CC=C5)C1

Isomeric SMILES

C[NH+]1CCN2C(=NC3=C2C=CC(=C3)NC(=O)C4=CC=C(C=C4)N5C=CC=C5)C1

InChI

InChI=1S/C22H21N5O/c1-25-12-13-27-20-9-6-17(14-19(20)24-21(27)15-25)23-22(28)16-4-7-18(8-5-16)26-10-2-3-11-26/h2-11,14H,12-13,15H2,1H3,(H,23,28)/p+1