hexakis(fluoranyl)antimony(1-); 3-[(4-octadecoxyphenyl)methyl]-1,3-benzothiazol-3-ium

Systemtic Name: hexakis(fluoranyl)antimony(1-); 3-[(4-octadecoxyphenyl)methyl]-1,3-benzothiazol-3-ium Openeye Name: hexafluoroantimony(1-); 3-[(4-octadecoxyphenyl)methyl]-1,3-benzothiazol-3-ium CAS Name: hexafluorostiboranuide; 3-[(4-octadecoxyphenyl)methyl]-1,3-benzothiazol-3-ium IUPAC Name: hexafluoroantimony(1-); 3-[(4-octadecoxyphenyl)methyl]-1,3-benzothiazol-3-ium Traditional Name: hexafluorostiboranuide; 3-(4-stearyloxybenzyl)-1,3-benzothiazol-3-ium Formula: C32H48F6NOSSb MolecularWeight: 730.545039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C[N+]2=CSC3=CC=CC=C32.F[Sb-](F)(F)(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C[N+]2=CSC3=CC=CC=C32.F[Sb-](F)(F)(F)(F)F

InChI

InChI=1S/C32H48NOS.6FH.Sb/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-26-34-30-24-22-29(23-25-30)27-33-28-35-32-21-18-17-20-31(32)33;;;;;;;/h17-18,20-25,28H,2-16,19,26-27H2,1H3;6*1H;/q+1;;;;;;;+5/p-6