phenyl-(1-prop-2-enylpyridin-1-ium-3-yl)methanone bromide

Systemtic Name: phenyl-(1-prop-2-enylpyridin-1-ium-3-yl)methanone bromide Openeye Name: (1-allylpyridin-1-ium-3-yl)-phenyl-methanone bromide CAS Name: phenyl-(1-prop-2-enyl-3-pyridin-1-iumyl)methanone bromide IUPAC Name: phenyl-(1-prop-2-enylpyridin-1-ium-3-yl)methanone bromide Traditional Name: (1-allylpyridin-1-ium-3-yl)-phenyl-methanone bromide Formula: C15H14BrNO MolecularWeight: 304.18176

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=CC=CC(=C1)C(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

C=CC[N+]1=CC=CC(=C1)C(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C15H14NO.BrH/c1-2-10-16-11-6-9-14(12-16)15(17)13-7-4-3-5-8-13;/h2-9,11-12H,1,10H2;1H/q+1;/p-1