1-azanyl-3-(4-propan-2-ylphenyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-2,4-dicarbonitrile

Systemtic Name: 1-azanyl-3-(4-propan-2-ylphenyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-2,4-dicarbonitrile Openeye Name: 1-amino-3-(4-isopropylphenyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-2,4-dicarbonitrile CAS Name: 1-amino-3-(4-propan-2-ylphenyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-2,4-dicarbonitrile IUPAC Name: 1-amino-3-(4-propan-2-ylphenyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-2,4-dicarbonitrile Traditional Name: 1-amino-3-p-cumenyl-5H-pyrido[1,2-a]benzimidazol-10-ium-2,4-dicarbonitrile Formula: C22H18N5+ MolecularWeight: 352.41182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C3=[N+](C4=CC=CC=C4N3)C(=C2C#N)N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C3=[N+](C4=CC=CC=C4N3)C(=C2C#N)N)C#N

InChI

InChI=1S/C22H17N5/c1-13(2)14-7-9-15(10-8-14)20-16(11-23)21(25)27-19-6-4-3-5-18(19)26-22(27)17(20)12-24/h3-10,13H,1-2H3,(H2,25,26)/p+1