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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N2O.BrH/c1-2-7-16-17-10-6-11-19(17)12-13-20(16)14-18(21)15-8-4-3-5-9-15;/h3-6,8-11H,2,7,12-14H2,1H3;1H/q+1;/p-1