1-[2-(4-methylphenoxy)ethyl]azepan-1-ium

Systemtic Name: 1-[2-(4-methylphenoxy)ethyl]azepan-1-ium Openeye Name: 1-[2-(4-methylphenoxy)ethyl]azepan-1-ium CAS Name: 1-[2-(4-methylphenoxy)ethyl]azepan-1-ium IUPAC Name: 1-[2-(4-methylphenoxy)ethyl]azepan-1-ium Traditional Name: 1-[2-(4-methylphenoxy)ethyl]azepan-1-ium Formula: C15H24NO+ MolecularWeight: 234.35716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH+]2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH+]2CCCCCC2

InChI

InChI=1S/C15H23NO/c1-14-6-8-15(9-7-14)17-13-12-16-10-4-2-3-5-11-16/h6-9H,2-5,10-13H2,1H3/p+1