1,1'-biphenyl; [2,6-bis(chloranyl)-3-methoxy-phenyl]methyl-phenyl-phosphanium; bromide

Systemtic Name: 1,1'-biphenyl; [2,6-bis(chloranyl)-3-methoxy-phenyl]methyl-phenyl-phosphanium; bromide Openeye Name: biphenyl; (2,6-dichloro-3-methoxy-phenyl)methyl-phenyl-phosphonium; bromide CAS Name: 1,1'-biphenyl; (2,6-dichloro-3-methoxyphenyl)methyl-phenylphosphonium; bromide IUPAC Name: 1,1'-biphenyl; (2,6-dichloro-3-methoxyphenyl)methyl-phenylphosphanium; bromide Traditional Name: biphenyl; (2,6-dichloro-3-methoxy-benzyl)-phenyl-phosphonium; bromide Formula: C26H24BrCl2OP MolecularWeight: 534.251921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13Cl2OP.C12H10.BrH/c1-17-13-8-7-12(15)11(14(13)16)9-18-10-5-3-2-4-6-10;1-3-7-11(8-4-1)12-9-5-2-6-10-12;/h2-8,18H,9H2,1H3;1-10H;1H