4-methoxy-3-(2-piperidin-1-ium-1-ylethoxy)benzenecarbonitrile

Systemtic Name: 4-methoxy-3-(2-piperidin-1-ium-1-ylethoxy)benzenecarbonitrile Openeye Name: 4-methoxy-3-(2-piperidin-1-ium-1-ylethoxy)benzonitrile CAS Name: 4-methoxy-3-[2-(1-piperidin-1-iumyl)ethoxy]benzonitrile IUPAC Name: 4-methoxy-3-(2-piperidin-1-ium-1-ylethoxy)benzonitrile Traditional Name: 4-methoxy-3-(2-piperidin-1-ium-1-ylethoxy)benzonitrile Formula: C15H21N2O2+ MolecularWeight: 261.33944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C#N)OCC[NH+]2CCCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)C#N)OCC[NH+]2CCCCC2

InChI

InChI=1S/C15H20N2O2/c1-18-14-6-5-13(12-16)11-15(14)19-10-9-17-7-3-2-4-8-17/h5-6,11H,2-4,7-10H2,1H3/p+1