2-phenanthridin-5-ium-5-yl-1-phenyl-ethanone bromide

Systemtic Name: 2-phenanthridin-5-ium-5-yl-1-phenyl-ethanone bromide Openeye Name: 2-phenanthridin-5-ium-5-yl-1-phenyl-ethanone bromide CAS Name: 2-(5-phenanthridin-5-iumyl)-1-phenylethanone bromide IUPAC Name: 2-phenanthridin-5-ium-5-yl-1-phenylethanone bromide Traditional Name: 2-phenanthridin-5-ium-5-yl-1-phenyl-ethanone bromide Formula: C21H16BrNO MolecularWeight: 378.26184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C4=CC=CC=C42.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC3=CC=CC=C3C4=CC=CC=C42.[Br-]

InChI

InChI=1S/C21H16NO.BrH/c23-21(16-8-2-1-3-9-16)15-22-14-17-10-4-5-11-18(17)19-12-6-7-13-20(19)22;/h1-14H,15H2;1H/q+1;/p-1