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

Systemtic Name: 1-(butylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(butylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(butylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(butylamino)-2-[(4-chlorophenyl)methyl]-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-(butylamino)-2-(4-chlorobenzyl)-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C24H24ClN4+ MolecularWeight: 403.92716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=C(C2=[N+]1C3=CC=CC=C3N2)C#N)C)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCNC1=C(C(=C(C2=[N+]1C3=CC=CC=C3N2)C#N)C)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H23ClN4/c1-3-4-13-27-23-19(14-17-9-11-18(25)12-10-17)16(2)20(15-26)24-28-21-7-5-6-8-22(21)29(23)24/h5-12H,3-4,13-14H2,1-2H3,(H,27,28)/p+1