1,1'-biphenyl; (2-chloranyl-5-methoxy-phenyl)methyl-phenyl-phosphanium; bromide

Systemtic Name: 1,1'-biphenyl; (2-chloranyl-5-methoxy-phenyl)methyl-phenyl-phosphanium; bromide Openeye Name: biphenyl; (2-chloro-5-methoxy-phenyl)methyl-phenyl-phosphonium; bromide CAS Name: 1,1'-biphenyl; (2-chloro-5-methoxyphenyl)methyl-phenylphosphonium; bromide IUPAC Name: 1,1'-biphenyl; (2-chloro-5-methoxyphenyl)methyl-phenylphosphanium; bromide Traditional Name: biphenyl; (2-chloro-5-methoxy-benzyl)-phenyl-phosphonium; bromide Formula: C26H25BrClOP MolecularWeight: 499.806861

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)C[PH2+]C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC=CC=C2.[Br-]

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)C[PH2+]C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C14H14ClOP.C12H10.BrH/c1-16-12-7-8-14(15)11(9-12)10-17-13-5-3-2-4-6-13;1-3-7-11(8-4-1)12-9-5-2-6-10-12;/h2-9,17H,10H2,1H3;1-10H;1H