1,1'-biphenyl; (2-chloranyl-4-nitro-phenyl)methyl-phenyl-phosphanium; bromide

Systemtic Name: 1,1'-biphenyl; (2-chloranyl-4-nitro-phenyl)methyl-phenyl-phosphanium; bromide Openeye Name: biphenyl; (2-chloro-4-nitro-phenyl)methyl-phenyl-phosphonium; bromide CAS Name: 1,1'-biphenyl; (2-chloro-4-nitrophenyl)methyl-phenylphosphonium; bromide IUPAC Name: 1,1'-biphenyl; (2-chloro-4-nitrophenyl)methyl-phenylphosphanium; bromide Traditional Name: biphenyl; (2-chloro-4-nitro-benzyl)-phenyl-phosphonium; bromide Formula: C25H22BrClNO2P MolecularWeight: 514.778441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClNO2P.C12H10.BrH/c14-13-8-11(15(16)17)7-6-10(13)9-18-12-4-2-1-3-5-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12;/h1-8,18H,9H2;1-10H;1H