2-(1-ethylpiperidin-1-ium-1-yl)-1-(4-iodophenyl)ethanone bromide

Systemtic Name: 2-(1-ethylpiperidin-1-ium-1-yl)-1-(4-iodophenyl)ethanone bromide Openeye Name: 2-(1-ethylpiperidin-1-ium-1-yl)-1-(4-iodophenyl)ethanone bromide CAS Name: 2-(1-ethyl-1-piperidin-1-iumyl)-1-(4-iodophenyl)ethanone bromide IUPAC Name: 2-(1-ethylpiperidin-1-ium-1-yl)-1-(4-iodophenyl)ethanone bromide Traditional Name: 2-(1-ethylpiperidin-1-ium-1-yl)-1-(4-iodophenyl)ethanone bromide Formula: C15H21BrINO MolecularWeight: 438.14181

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCCCC1)CC(=O)C2=CC=C(C=C2)I.[Br-]

Isomeric SMILES

CC[N+]1(CCCCC1)CC(=O)C2=CC=C(C=C2)I.[Br-]

InChI

InChI=1S/C15H21INO.BrH/c1-2-17(10-4-3-5-11-17)12-15(18)13-6-8-14(16)9-7-13;/h6-9H,2-5,10-12H2,1H3;1H/q+1;/p-1