1,1'-biphenyl; (2-cyanophenyl)methyl-phenyl-phosphanium; bromide

Systemtic Name: 1,1'-biphenyl; (2-cyanophenyl)methyl-phenyl-phosphanium; bromide Openeye Name: biphenyl; (2-cyanophenyl)methyl-phenyl-phosphonium; bromide CAS Name: 1,1'-biphenyl; (2-cyanophenyl)methyl-phenylphosphonium; bromide IUPAC Name: 1,1'-biphenyl; (2-cyanophenyl)methyl-phenylphosphanium; bromide Traditional Name: biphenyl; (2-cyanobenzyl)-phenyl-phosphonium; bromide Formula: C26H23BrNP MolecularWeight: 460.345281

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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=CC=C2C#N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)[PH2+]CC2=CC=CC=C2C#N.[Br-]

InChI

InChI=1S/C14H12NP.C12H10.BrH/c15-10-12-6-4-5-7-13(12)11-16-14-8-2-1-3-9-14;1-3-7-11(8-4-1)12-9-5-2-6-10-12;/h1-9,16H,11H2;1-10H;1H