1-(4-bromophenyl)-2-(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide

Systemtic Name: 1-(4-bromophenyl)-2-(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide CAS Name: 1-(4-bromophenyl)-2-(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-(1-ethyl-6-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide Formula: C18H20Br2N2O MolecularWeight: 440.1722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](CCN2C1=CC=C2C)CC(=O)C3=CC=C(C=C3)Br.[Br-]

Isomeric SMILES

CCC1=[N+](CCN2C1=CC=C2C)CC(=O)C3=CC=C(C=C3)Br.[Br-]

InChI

InChI=1S/C18H20BrN2O.BrH/c1-3-16-17-9-4-13(2)21(17)11-10-20(16)12-18(22)14-5-7-15(19)8-6-14;/h4-9H,3,10-12H2,1-2H3;1H/q+1;/p-1