2,4,6-triphenyl-4-(2-phenylethynyl)-1,4-oxaphosphinin-4-ium bromide

Systemtic Name: 2,4,6-triphenyl-4-(2-phenylethynyl)-1,4-oxaphosphinin-4-ium bromide Openeye Name: 2,4,6-triphenyl-4-(2-phenylethynyl)-1,4-oxaphosphinin-4-ium bromide CAS Name: 2,4,6-triphenyl-4-(2-phenylethynyl)-1,4-oxaphosphorin-4-ium bromide IUPAC Name: 2,4,6-triphenyl-4-(2-phenylethynyl)-1,4-oxaphosphinin-4-ium bromide Traditional Name: 2,4,6-triphenyl-4-(2-phenylethynyl)-1,4-oxaphosphorin-4-ium bromide Formula: C30H22BrOP MolecularWeight: 509.372841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#C[P+]2(C=C(OC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C#C[P+]2(C=C(OC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C30H22OP.BrH/c1-5-13-25(14-6-1)21-22-32(28-19-11-4-12-20-28)23-29(26-15-7-2-8-16-26)31-30(24-32)27-17-9-3-10-18-27;/h1-20,23-24H;1H/q+1;/p-1