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

Systemtic Name: 1-[4-(2-naphthalen-1-yloxyethyl)piperazin-4-ium-1-yl]-3-propan-2-yl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-isopropyl-1-[4-[2-(1-naphthyloxy)ethyl]piperazin-4-ium-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-[2-(1-naphthalenyloxy)ethyl]-1-piperazin-4-iumyl]-3-propan-2-yl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(2-naphthalen-1-yloxyethyl)piperazin-4-ium-1-yl]-3-propan-2-ylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-isopropyl-1-[4-[2-(1-naphthoxy)ethyl]piperazin-4-ium-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C31H32N5O+ MolecularWeight: 490.61868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CC[NH+](CC4)CCOC5=CC=CC6=CC=CC=C65)C#N

Isomeric SMILES

CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CC[NH+](CC4)CCOC5=CC=CC6=CC=CC=C65)C#N

InChI

InChI=1S/C31H31N5O/c1-22(2)25-20-30(36-28-12-6-5-11-27(28)33-31(36)26(25)21-32)35-16-14-34(15-17-35)18-19-37-29-13-7-9-23-8-3-4-10-24(23)29/h3-13,20,22H,14-19H2,1-2H3/p+1