11-(oxan-2-yloxy)undecyl-triphenyl-phosphanium bromide

Systemtic Name: 11-(oxan-2-yloxy)undecyl-triphenyl-phosphanium bromide Openeye Name: triphenyl(11-tetrahydropyran-2-yloxyundecyl)phosphonium bromide CAS Name: 11-(2-oxanyloxy)undecyl-triphenylphosphonium bromide IUPAC Name: 11-(oxan-2-yloxy)undecyl-triphenylphosphanium bromide Traditional Name: triphenyl(11-tetrahydropyran-2-yloxyundecyl)phosphonium bromide Formula: C34H46BrO2P MolecularWeight: 597.605601

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCCCCCCCCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CCOC(C1)OCCCCCCCCCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C34H46O2P.BrH/c1(2-4-6-18-28-35-34-27-17-19-29-36-34)3-5-7-20-30-37(31-21-11-8-12-22-31,32-23-13-9-14-24-32)33-25-15-10-16-26-33;/h8-16,21-26,34H,1-7,17-20,27-30H2;1H/q+1;/p-1