methyl-[4-octadecoxy-2-(phenylmethyl)phenyl]iodanium hexafluorophosphate

Systemtic Name: methyl-[4-octadecoxy-2-(phenylmethyl)phenyl]iodanium hexafluorophosphate Openeye Name: (2-benzyl-4-octadecoxy-phenyl)-methyl-iodonium hexafluorophosphate CAS Name: methyl-[4-octadecoxy-2-(phenylmethyl)phenyl]iodonium hexafluorophosphate IUPAC Name: (2-benzyl-4-octadecoxyphenyl)-methyliodanium hexafluorophosphate Traditional Name: (2-benzyl-4-stearyloxy-phenyl)-methyl-iodonium hexafluorophosphate Formula: C32H50F6IOP MolecularWeight: 722.60745

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)[I+]C)CC2=CC=CC=C2.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)[I+]C)CC2=CC=CC=C2.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C32H50IO.F6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26-34-31-24-25-32(33-2)30(28-31)27-29-22-19-18-20-23-29;1-7(2,3,4,5)6/h18-20,22-25,28H,3-17,21,26-27H2,1-2H3;/q+1;-1