4-[2-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]ethoxy]benzonitrile CAS Name: 4-[2-[2-(4-methyl-1-piperazin-4-iumyl)ethoxy]ethoxy]benzonitrile IUPAC Name: 4-[2-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]ethoxy]benzonitrile Traditional Name: 4-[2-[2-(4-methylpiperazin-4-ium-1-yl)ethoxy]ethoxy]benzonitrile Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCOCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

C[NH+]1CCN(CC1)CCOCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H23N3O2/c1-18-6-8-19(9-7-18)10-11-20-12-13-21-16-4-2-15(14-17)3-5-16/h2-5H,6-13H2,1H3/p+1