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

Systemtic Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-methyl-2-(2-methylprop-2-enyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-methyl-2-(2-methylallyl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-3-methyl-2-(2-methylprop-2-enyl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-methyl-2-(2-methylprop-2-enyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-methyl-2-(2-methylallyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C23H28N5O+ MolecularWeight: 390.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC(=C)C)N4CC[NH+](CC4)CCO)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1CC(=C)C)N4CC[NH+](CC4)CCO)C#N

InChI

InChI=1S/C23H27N5O/c1-16(2)14-18-17(3)19(15-24)22-25-20-6-4-5-7-21(20)28(22)23(18)27-10-8-26(9-11-27)12-13-29/h4-7,29H,1,8-14H2,2-3H3/p+1