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

Systemtic Name: 2-(1-ethyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(4-methylphenyl)ethanone bromide Openeye Name: 2-(1-ethyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(p-tolyl)ethanone bromide CAS Name: 2-(1-ethyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(4-methylphenyl)ethanone bromide IUPAC Name: 2-(1-ethyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(4-methylphenyl)ethanone bromide Traditional Name: 2-(1-ethyl-3,4-dihydropyrrolo[1,2-a]pyrazin-5-ium-2-yl)-1-(p-tolyl)ethanone bromide Formula: C18H21BrN2O MolecularWeight: 361.27614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC=[N+]2CCN1CC(=O)C3=CC=C(C=C3)C.[Br-]

Isomeric SMILES

CCC1=C2C=CC=[N+]2CCN1CC(=O)C3=CC=C(C=C3)C.[Br-]

InChI

InChI=1S/C18H21N2O.BrH/c1-3-16-17-5-4-10-19(17)11-12-20(16)13-18(21)15-8-6-14(2)7-9-15;/h4-10H,3,11-13H2,1-2H3;1H/q+1;/p-1