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

Systemtic Name: 2-(1-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(4-methylphenyl)ethanone bromide Openeye Name: 2-(1-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(p-tolyl)ethanone bromide CAS Name: 2-(1-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(4-methylphenyl)ethanone bromide IUPAC Name: 2-(1-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(4-methylphenyl)ethanone bromide Traditional Name: 2-(1-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(p-tolyl)ethanone bromide Formula: C17H19BrN2O MolecularWeight: 347.24956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2CC[N+]3=CC=CC3=C2C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2CC[N+]3=CC=CC3=C2C.[Br-]

InChI

InChI=1S/C17H19N2O.BrH/c1-13-5-7-15(8-6-13)17(20)12-19-11-10-18-9-3-4-16(18)14(19)2;/h3-9H,10-12H2,1-2H3;1H/q+1;/p-1