1-naphthalen-2-yl-2-(1,10-phenanthrolin-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-naphthalen-2-yl-2-(1,10-phenanthrolin-1-ium-1-yl)ethanone bromide Openeye Name: 1-(2-naphthyl)-2-(1,10-phenanthrolin-1-ium-1-yl)ethanone bromide CAS Name: 1-(2-naphthalenyl)-2-(1,10-phenanthrolin-1-ium-1-yl)ethanone bromide IUPAC Name: 1-naphthalen-2-yl-2-(1,10-phenanthrolin-1-ium-1-yl)ethanone bromide Traditional Name: 1-(2-naphthyl)-2-(1,10-phenanthrolin-1-ium-1-yl)ethanone bromide Formula: C24H17BrN2O MolecularWeight: 429.30858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)C[N+]3=CC=CC4=C3C5=C(C=CC=N5)C=C4.[Br-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)C[N+]3=CC=CC4=C3C5=C(C=CC=N5)C=C4.[Br-]

InChI

InChI=1S/C24H17N2O.BrH/c27-22(21-12-9-17-5-1-2-6-20(17)15-21)16-26-14-4-8-19-11-10-18-7-3-13-25-23(18)24(19)26;/h1-15H,16H2;1H/q+1;/p-1