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

Systemtic Name: 3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-(2-pyridin-1-iumylmethylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(pyridin-1-ium-2-ylmethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C19H16N5+ MolecularWeight: 314.36384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)NCC4=CC=CC=[NH+]4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)NCC4=CC=CC=[NH+]4)C#N

InChI

InChI=1S/C19H15N5/c1-13-10-18(22-12-14-6-4-5-9-21-14)24-17-8-3-2-7-16(17)23-19(24)15(13)11-20/h2-10,22H,12H2,1H3/p+1