1-(4-bromophenyl)-2-(1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)ethanone bromide

Systemtic Name: 1-(4-bromophenyl)-2-(1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-(1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)ethanone bromide CAS Name: 1-(4-bromophenyl)-2-(1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-(1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-(1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)ethanone bromide Formula: C18H20Br2N2O MolecularWeight: 440.1722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C=CC=[N+]2CCN1CC(=O)C3=CC=C(C=C3)Br.[Br-]

Isomeric SMILES

CCCC1=C2C=CC=[N+]2CCN1CC(=O)C3=CC=C(C=C3)Br.[Br-]

InChI

InChI=1S/C18H20BrN2O.BrH/c1-2-4-16-17-5-3-10-20(17)11-12-21(16)13-18(22)14-6-8-15(19)9-7-14;/h3,5-10H,2,4,11-13H2,1H3;1H/q+1;/p-1