1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-ethyl-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C32H32N5+ MolecularWeight: 486.62998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CC[NH+](CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H31N5/c1-3-26-23(2)27(22-33)31-34-28-16-10-11-17-29(28)37(31)32(26)36-20-18-35(19-21-36)30(24-12-6-4-7-13-24)25-14-8-5-9-15-25/h4-17,30H,3,18-21H2,1-2H3/p+1