1-(5-bromanylthiophen-2-yl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanone

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzoylpyridin-1-ium-1-yl)-1-(5-bromo-2-thienyl)ethanone CAS Name: 2-(4-benzoyl-1-pyridin-1-iumyl)-1-(5-bromo-2-thiophenyl)ethanone IUPAC Name: 2-(4-benzoylpyridin-1-ium-1-yl)-1-(5-bromothiophen-2-yl)ethanone Traditional Name: 2-(4-benzoylpyridin-1-ium-1-yl)-1-(5-bromo-2-thienyl)ethanone Formula: C18H13BrNO2S+ MolecularWeight: 387.27032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)CC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)CC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H13BrNO2S/c19-17-7-6-16(23-17)15(21)12-20-10-8-14(9-11-20)18(22)13-4-2-1-3-5-13/h1-11H,12H2/q+1