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

Systemtic Name: 4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethoxy]benzonitrile IUPAC Name: 4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethoxy]benzonitrile Traditional Name: 4-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethoxy]benzonitrile Formula: C15H20N3O2+ MolecularWeight: 274.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)C#N

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H19N3O2/c1-2-17-7-9-18(10-8-17)15(19)12-20-14-5-3-13(11-16)4-6-14/h3-6H,2,7-10,12H2,1H3/p+1