methyl-(4-octadecoxyphenyl)-(phenylmethyl)sulfanium hexafluorophosphate

Systemtic Name: methyl-(4-octadecoxyphenyl)-(phenylmethyl)sulfanium hexafluorophosphate Openeye Name: benzyl-methyl-(4-octadecoxyphenyl)sulfonium hexafluorophosphate CAS Name: methyl-(4-octadecoxyphenyl)-(phenylmethyl)sulfonium hexafluorophosphate IUPAC Name: benzyl-methyl-(4-octadecoxyphenyl)sulfanium hexafluorophosphate Traditional Name: benzyl-methyl-(4-stearyloxyphenyl)sulfonium hexafluorophosphate Formula: C32H51F6OPS MolecularWeight: 628.77592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H51OS.F6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28-33-31-24-26-32(27-25-31)34(2)29-30-22-19-18-20-23-30;1-7(2,3,4,5)6/h18-20,22-27H,3-17,21,28-29H2,1-2H3;/q+1;-1