1,1'-biphenyl; (4-nitrophenyl)methyl-phenyl-phosphanium; bromide

Systemtic Name: 1,1'-biphenyl; (4-nitrophenyl)methyl-phenyl-phosphanium; bromide Openeye Name: biphenyl; (4-nitrophenyl)methyl-phenyl-phosphonium; bromide CAS Name: 1,1'-biphenyl; (4-nitrophenyl)methyl-phenylphosphonium; bromide IUPAC Name: 1,1'-biphenyl; (4-nitrophenyl)methyl-phenylphosphanium; bromide Traditional Name: biphenyl; (4-nitrobenzyl)-phenyl-phosphonium; bromide Formula: C25H23BrNO2P MolecularWeight: 480.333381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)[PH2+]CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)[PH2+]CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C13H12NO2P.C12H10.BrH/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13;1-3-7-11(8-4-1)12-9-5-2-6-10-12;/h1-9,17H,10H2;1-10H;1H