2-[4-[2-(4-cyanophenoxy)ethanoyl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[2-(4-cyanophenoxy)ethanoyl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[2-(4-cyanophenoxy)acetyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[2-(4-cyanophenoxy)-1-oxoethyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[2-(4-cyanophenoxy)acetyl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[2-(4-cyanophenoxy)acetyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C17H23N4O3+ MolecularWeight: 331.38952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O3/c1-19(2)16(22)12-20-7-9-21(10-8-20)17(23)13-24-15-5-3-14(11-18)4-6-15/h3-6H,7-10,12-13H2,1-2H3/p+1