[(4-methylphenyl)-triphenylphosphaniumyl-methyl]-triphenyl-phosphanium dichloride

Systemtic Name: [(4-methylphenyl)-triphenylphosphaniumyl-methyl]-triphenyl-phosphanium dichloride Openeye Name: triphenyl-[p-tolyl(triphenylphosphaniumyl)methyl]phosphonium dichloride CAS Name: [(4-methylphenyl)-triphenylphosphiniumylmethyl]-triphenylphosphonium dichloride IUPAC Name: [(4-methylphenyl)-triphenylphosphaniumylmethyl]-triphenylphosphanium dichloride Traditional Name: triphenyl-[p-tolyl(triphenylphosphiniumyl)methyl]phosphonium dichloride Formula: C44H38Cl2P2 MolecularWeight: 699.626042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.[Cl-].[Cl-]

InChI

InChI=1S/C44H38P2.2ClH/c1-36-32-34-37(35-33-36)44(45(38-20-8-2-9-21-38,39-22-10-3-11-23-39)40-24-12-4-13-25-40)46(41-26-14-5-15-27-41,42-28-16-6-17-29-42)43-30-18-7-19-31-43;;/h2-35,44H,1H3;2*1H/q+2;;/p-2