1-(4-bromophenyl)-2-(4-pentylpyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-(4-bromophenyl)-2-(4-pentylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-(4-bromophenyl)-2-(4-pentylpyridin-1-ium-1-yl)ethanone CAS Name: 1-(4-bromophenyl)-2-(4-pentyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-(4-bromophenyl)-2-(4-pentylpyridin-1-ium-1-yl)ethanone Traditional Name: 2-(4-amylpyridin-1-ium-1-yl)-1-(4-bromophenyl)ethanone Formula: C18H21BrNO+ MolecularWeight: 347.26944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCC1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H21BrNO/c1-2-3-4-5-15-10-12-20(13-11-15)14-18(21)16-6-8-17(19)9-7-16/h6-13H,2-5,14H2,1H3/q+1