1-(furan-2-yl)-2-[5-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanone bromide

Systemtic Name: 1-(furan-2-yl)-2-[5-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanone bromide Openeye Name: 2-(5-benzyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(2-furyl)ethanone bromide CAS Name: 1-(2-furanyl)-2-[5-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanone bromide IUPAC Name: 2-(5-benzyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(furan-2-yl)ethanone bromide Traditional Name: 2-(2-benzyl-1-pyrrolin-1-ium-1-yl)-1-(2-furyl)ethanone bromide Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[N+](C1)CC(=O)C2=CC=CO2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1CC(=[N+](C1)CC(=O)C2=CC=CO2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C17H18NO2.BrH/c19-16(17-9-5-11-20-17)13-18-10-4-8-15(18)12-14-6-2-1-3-7-14;/h1-3,5-7,9,11H,4,8,10,12-13H2;1H/q+1;/p-1