dimethyl-[(4-octadecoxyphenyl)methyl]-phenyl-azanium hexafluorophosphate

Systemtic Name: dimethyl-[(4-octadecoxyphenyl)methyl]-phenyl-azanium hexafluorophosphate Openeye Name: dimethyl-[(4-octadecoxyphenyl)methyl]-phenyl-ammonium hexafluorophosphate CAS Name: dimethyl-[(4-octadecoxyphenyl)methyl]-phenylammonium hexafluorophosphate IUPAC Name: dimethyl-[(4-octadecoxyphenyl)methyl]-phenylazanium hexafluorophosphate Traditional Name: dimethyl-phenyl-(4-stearyloxybenzyl)ammonium hexafluorophosphate Formula: C33H54F6NOP MolecularWeight: 625.75214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H54NO.F6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-29-35-33-27-25-31(26-28-33)30-34(2,3)32-23-20-19-21-24-32;1-7(2,3,4,5)6/h19-21,23-28H,4-18,22,29-30H2,1-3H3;/q+1;-1