1-(4-cyclopentylpiperazin-4-ium-1-yl)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 1-(4-cyclopentylpiperazin-4-ium-1-yl)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 1-(4-cyclopentylpiperazin-4-ium-1-yl)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 1-(4-cyclopentyl-1-piperazin-4-iumyl)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 1-(4-cyclopentylpiperazin-4-ium-1-yl)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 1-(4-cyclopentylpiperazin-4-ium-1-yl)-3-propyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C24H31N5+2 MolecularWeight: 389.53644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)N4CC[NH+](CC4)C5CCCC5

Isomeric SMILES

CCCC1=CC(=[N+]2C3=CC=CC=C3NC2=C1C#N)N4CC[NH+](CC4)C5CCCC5

InChI

InChI=1S/C24H29N5/c1-2-7-18-16-23(28-14-12-27(13-15-28)19-8-3-4-9-19)29-22-11-6-5-10-21(22)26-24(29)20(18)17-25/h5-6,10-11,16,19H,2-4,7-9,12-15H2,1H3/p+2