1-(4-bromophenyl)-2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]ethanone bromide

Systemtic Name: 1-(4-bromophenyl)-2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]ethanone bromide CAS Name: 1-(4-bromophenyl)-2-[2-(cyclohexylamino)-1-pyridin-1-iumyl]ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]ethanone bromide Formula: C19H22Br2N2O MolecularWeight: 454.19878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=CC=CC=[N+]2CC(=O)C3=CC=C(C=C3)Br.[Br-]

Isomeric SMILES

C1CCC(CC1)NC2=CC=CC=[N+]2CC(=O)C3=CC=C(C=C3)Br.[Br-]

InChI

InChI=1S/C19H21BrN2O.BrH/c20-16-11-9-15(10-12-16)18(23)14-22-13-5-4-8-19(22)21-17-6-2-1-3-7-17;/h4-5,8-13,17H,1-3,6-7,14H2;1H