5,5-bis(3-methylphenyl)-4-phenyl-4H-1,3-oxazole; nickel(2+); dibromide

Systemtic Name: 5,5-bis(3-methylphenyl)-4-phenyl-4H-1,3-oxazole; nickel(2+); dibromide Openeye Name: nickelous 5,5-bis(m-tolyl)-4-phenyl-4H-oxazole dibromide CAS Name: 5,5-bis(3-methylphenyl)-4-phenyl-4H-oxazole; nickel(2+); dibromide IUPAC Name: 5,5-bis(3-methylphenyl)-4-phenyl-4H-1,3-oxazole; nickel(2+); dibromide Traditional Name: nickelous 5,5-bis(m-tolyl)-4-phenyl-2-oxazoline dibromide Formula: C23H21Br2NNiO MolecularWeight: 545.92034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2(C(N=CO2)C3=CC=CC=C3)C4=CC(=CC=C4)C.[Ni+2].[Br-].[Br-]

Isomeric SMILES

CC1=CC=CC(=C1)C2(C(N=CO2)C3=CC=CC=C3)C4=CC(=CC=C4)C.[Ni+2].[Br-].[Br-]

InChI

InChI=1S/C23H21NO.2BrH.Ni/c1-17-8-6-12-20(14-17)23(21-13-7-9-18(2)15-21)22(24-16-25-23)19-10-4-3-5-11-19;;;/h3-16,22H,1-2H3;2*1H;/q;;;+2/p-2