2-morpholin-4-ium-4-yl-1-(3,4,5-trimethoxyphenyl)ethanone bromide

Systemtic Name: 2-morpholin-4-ium-4-yl-1-(3,4,5-trimethoxyphenyl)ethanone bromide Openeye Name: 2-morpholin-4-ium-4-yl-1-(3,4,5-trimethoxyphenyl)ethanone bromide CAS Name: 2-(4-morpholin-4-iumyl)-1-(3,4,5-trimethoxyphenyl)ethanone bromide IUPAC Name: 2-morpholin-4-ium-4-yl-1-(3,4,5-trimethoxyphenyl)ethanone bromide Traditional Name: 2-morpholin-4-ium-4-yl-1-(3,4,5-trimethoxyphenyl)ethanone bromide Formula: C15H22BrNO5 MolecularWeight: 376.24288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C[NH+]2CCOCC2.[Br-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C[NH+]2CCOCC2.[Br-]

InChI

InChI=1S/C15H21NO5.BrH/c1-18-13-8-11(9-14(19-2)15(13)20-3)12(17)10-16-4-6-21-7-5-16;/h8-9H,4-7,10H2,1-3H3;1H