2-(azepan-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-(azepan-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone Openeye Name: 2-(azepan-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone CAS Name: 2-(1-azepan-1-iumyl)-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-(azepan-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone Traditional Name: 2-(azepan-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone Formula: C15H22NO2+ MolecularWeight: 248.34068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[NH+]2CCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[NH+]2CCCCCC2

InChI

InChI=1S/C15H21NO2/c1-18-14-8-6-13(7-9-14)15(17)12-16-10-4-2-3-5-11-16/h6-9H,2-5,10-12H2,1H3/p+1