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

Systemtic Name: 1-(cyclohexylamino)-3-methyl-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(cyclohexylamino)-3-methyl-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(cyclohexylamino)-3-methyl-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(cyclohexylamino)-3-methyl-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-(cyclohexylamino)-3-methyl-2-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C22H27N4+ MolecularWeight: 347.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NC4CCCCC4

Isomeric SMILES

CCCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NC4CCCCC4

InChI

InChI=1S/C22H26N4/c1-3-9-17-15(2)18(14-23)22-25-19-12-7-8-13-20(19)26(22)21(17)24-16-10-5-4-6-11-16/h7-8,12-13,16H,3-6,9-11H2,1-2H3,(H,24,25)/p+1