1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-propan-2-yl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-propan-2-yl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-isopropyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-3-propan-2-yl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-isopropyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H26N5O+ MolecularWeight: 364.46404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CC[NH+](CC4)CCO)C#N

Isomeric SMILES

CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CC[NH+](CC4)CCO)C#N

InChI

InChI=1S/C21H25N5O/c1-15(2)16-13-20(25-9-7-24(8-10-25)11-12-27)26-19-6-4-3-5-18(19)23-21(26)17(16)14-22/h3-6,13,15,27H,7-12H2,1-2H3/p+1