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

Systemtic Name: 1-(cyclohexylamino)-3-methyl-2-prop-2-enyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 2-allyl-1-(cyclohexylamino)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(cyclohexylamino)-3-methyl-2-prop-2-enyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(cyclohexylamino)-3-methyl-2-prop-2-enyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-allyl-1-(cyclohexylamino)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C22H25N4+ MolecularWeight: 345.4607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=C1CC=C)NC4CCCCC4)C#N

Isomeric SMILES

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=C1CC=C)NC4CCCCC4)C#N

InChI

InChI=1S/C22H24N4/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/h3,7-8,12-13,16H,1,4-6,9-11H2,2H3,(H,24,25)/p+1