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

Systemtic Name: 3-propyl-1-(propylamino)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 3-propyl-1-(propylamino)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 3-propyl-1-(propylamino)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 3-propyl-1-(propylamino)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 3-propyl-1-(propylamino)-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C18H21N4+ MolecularWeight: 293.38614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)NCCC

Isomeric SMILES

CCCC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)NCCC

InChI

InChI=1S/C18H20N4/c1-3-7-13-11-17(20-10-4-2)22-16-9-6-5-8-15(16)21-18(22)14(13)12-19/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,20,21)/p+1