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

Systemtic Name: 1-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-[2-(3-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H28N5O2+ MolecularWeight: 442.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CC[NH+](CC4)CCOC5=CC=CC(=C5)OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CC[NH+](CC4)CCOC5=CC=CC(=C5)OC)C#N

InChI

InChI=1S/C26H27N5O2/c1-19-16-25(31-24-9-4-3-8-23(24)28-26(31)22(19)18-27)30-12-10-29(11-13-30)14-15-33-21-7-5-6-20(17-21)32-2/h3-9,16-17H,10-15H2,1-2H3/p+1