1-[3-(dimethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 1-[3-(dimethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-[3-(dimethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-[3-(dimethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-[3-(dimethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-[3-(dimethylamino)propylamino]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C18H22N5+ MolecularWeight: 308.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)NCCCN(C)C

Isomeric SMILES

CC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)NCCCN(C)C

InChI

InChI=1S/C18H21N5/c1-13-11-17(20-9-6-10-22(2)3)23-16-8-5-4-7-15(16)21-18(23)14(13)12-19/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,20,21)/p+1