1-[2-(3-ethoxyphenoxy)ethyl]azepan-1-ium

Systemtic Name: 1-[2-(3-ethoxyphenoxy)ethyl]azepan-1-ium Openeye Name: 1-[2-(3-ethoxyphenoxy)ethyl]azepan-1-ium CAS Name: 1-[2-(3-ethoxyphenoxy)ethyl]azepan-1-ium IUPAC Name: 1-[2-(3-ethoxyphenoxy)ethyl]azepan-1-ium Traditional Name: 1-[2-(3-ethoxyphenoxy)ethyl]azepan-1-ium Formula: C16H26NO2+ MolecularWeight: 264.38314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC=C1)OCC[NH+]2CCCCCC2

Isomeric SMILES

CCOC1=CC(=CC=C1)OCC[NH+]2CCCCCC2

InChI

InChI=1S/C16H25NO2/c1-2-18-15-8-7-9-16(14-15)19-13-12-17-10-5-3-4-6-11-17/h7-9,14H,2-6,10-13H2,1H3/p+1