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

Systemtic Name: 1-(4-bromophenyl)-2-[4-[(E)-2-phenylethenyl]pyridin-1-ium-1-yl]ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-[4-[(E)-styryl]pyridin-1-ium-1-yl]ethanone bromide CAS Name: 1-(4-bromophenyl)-2-[4-[(E)-2-phenylethenyl]-1-pyridin-1-iumyl]ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-[4-[(E)-2-phenylethenyl]pyridin-1-ium-1-yl]ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-[4-[(E)-styryl]pyridin-1-ium-1-yl]ethanone bromide Formula: C21H17Br2NO MolecularWeight: 459.17378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=CC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Br.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=CC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Br.[Br-]

InChI

InChI=1S/C21H17BrNO.BrH/c22-20-10-8-19(9-11-20)21(24)16-23-14-12-18(13-15-23)7-6-17-4-2-1-3-5-17;/h1-15H,16H2;1H/q+1;/p-1/b7-6+;