3,3-dimethyl-1-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)butan-2-one bromide

Systemtic Name: 3,3-dimethyl-1-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)butan-2-one bromide Openeye Name: 3,3-dimethyl-1-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)butan-2-one bromide CAS Name: 3,3-dimethyl-1-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)-2-butanone bromide IUPAC Name: 3,3-dimethyl-1-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)butan-2-one bromide Traditional Name: 3,3-dimethyl-1-(3-phenyl-6,7-dihydro-5H-pyrrol[1,2-a]imidazol-1-ium-1-yl)butan-2-one bromide Formula: C18H23BrN2O MolecularWeight: 363.29202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C[N+]1=C2CCCN2C(=C1)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC(C)(C)C(=O)C[N+]1=C2CCCN2C(=C1)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C18H23N2O.BrH/c1-18(2,3)16(21)13-19-12-15(14-8-5-4-6-9-14)20-11-7-10-17(19)20;/h4-6,8-9,12H,7,10-11,13H2,1-3H3;1H/q+1;/p-1