tricyclohexyl-[[4-[4-(tricyclohexylphosphaniumylmethyl)phenyl]carbonylphenyl]methyl]phosphanium dibromide

Systemtic Name: tricyclohexyl-[[4-[4-(tricyclohexylphosphaniumylmethyl)phenyl]carbonylphenyl]methyl]phosphanium dibromide Openeye Name: tricyclohexyl-[[4-[4-(tricyclohexylphosphaniumylmethyl)benzoyl]phenyl]methyl]phosphonium dibromide CAS Name: tricyclohexyl-[[4-[oxo-[4-(tricyclohexylphosphiniumylmethyl)phenyl]methyl]phenyl]methyl]phosphonium dibromide IUPAC Name: tricyclohexyl-[[4-[4-(tricyclohexylphosphaniumylmethyl)benzoyl]phenyl]methyl]phosphanium dibromide Traditional Name: tricyclohexyl-[4-[4-(tricyclohexylphosphiniumylmethyl)benzoyl]benzyl]phosphonium dibromide Formula: C51H78Br2OP2 MolecularWeight: 928.919942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[P+](CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C[P+](C4CCCCC4)(C5CCCCC5)C6CCCCC6)(C7CCCCC7)C8CCCCC8.[Br-].[Br-]

Isomeric SMILES

C1CCC(CC1)[P+](CC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C[P+](C4CCCCC4)(C5CCCCC5)C6CCCCC6)(C7CCCCC7)C8CCCCC8.[Br-].[Br-]

InChI

InChI=1S/C51H78OP2.2BrH/c52-51(43-35-31-41(32-36-43)39-53(45-19-7-1-8-20-45,46-21-9-2-10-22-46)47-23-11-3-12-24-47)44-37-33-42(34-38-44)40-54(48-25-13-4-14-26-48,49-27-15-5-16-28-49)50-29-17-6-18-30-50;;/h31-38,45-50H,1-30,39-40H2;2*1H/q+2;;/p-2