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

Systemtic Name: 1-(4-methoxyphenyl)-2-(6-methyl-1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-(6-methyl-1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(6-methyl-1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-(6-methyl-1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-(6-methyl-1-propyl-3,4-dihydropyrrolo[1,2-a]pyrazin-2-ium-2-yl)ethanone bromide Formula: C20H25BrN2O2 MolecularWeight: 405.3287

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](CCN2C1=CC=C2C)CC(=O)C3=CC=C(C=C3)OC.[Br-]

Isomeric SMILES

CCCC1=[N+](CCN2C1=CC=C2C)CC(=O)C3=CC=C(C=C3)OC.[Br-]

InChI

InChI=1S/C20H25N2O2.BrH/c1-4-5-18-19-11-6-15(2)22(19)13-12-21(18)14-20(23)16-7-9-17(24-3)10-8-16;/h6-11H,4-5,12-14H2,1-3H3;1H/q+1;/p-1