2-ethyl-3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 2-ethyl-3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-ethyl-3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-ethyl-3-methyl-1-(2-pyridin-1-iumylmethylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-ethyl-3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-ethyl-3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H20N5+ MolecularWeight: 342.417

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCC4=CC=CC=[NH+]4

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCC4=CC=CC=[NH+]4

InChI

InChI=1S/C21H19N5/c1-3-16-14(2)17(12-22)21-25-18-9-4-5-10-19(18)26(21)20(16)24-13-15-8-6-7-11-23-15/h4-11,24H,3,13H2,1-2H3/p+1