4-[3-(4-bromophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[3-(4-bromophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[3-(4-bromophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[3-(4-bromophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[3-(4-bromophenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[3-(4-bromophenyl)-6,7-dihydro-5H-pyrrol[1,2-a]imidazol-1-ium-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C23H22BrN4O+ MolecularWeight: 450.35098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)[N+]3=C4CCCN4C(=C3)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)[N+]3=C4CCCN4C(=C3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C23H22BrN4O/c1-16-22(23(29)28(25(16)2)19-7-4-3-5-8-19)27-15-20(26-14-6-9-21(26)27)17-10-12-18(24)13-11-17/h3-5,7-8,10-13,15H,6,9,14H2,1-2H3/q+1