1-(4-bromophenyl)-2-[4-(4-phenylphenyl)pyrimidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[4-(4-phenylphenyl)pyrimidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[4-(4-phenylphenyl)pyrimidin-1-ium-1-yl]ethanone CAS Name: 1-(4-bromophenyl)-2-[4-(4-phenylphenyl)-1-pyrimidin-1-iumyl]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[4-(4-phenylphenyl)pyrimidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[4-(4-phenylphenyl)pyrimidin-1-ium-1-yl]ethanone Formula: C24H18BrN2O+ MolecularWeight: 430.31652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=[N+](C=C3)CC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=[N+](C=C3)CC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H18BrN2O/c25-22-12-10-21(11-13-22)24(28)16-27-15-14-23(26-17-27)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-15,17H,16H2/q+1