butyl-methyl-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]sulfanium; methyl sulfate

Systemtic Name: butyl-methyl-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]sulfanium; methyl sulfate Openeye Name: butyl-methyl-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]sulfonium; methyl sulfate CAS Name: butyl-methyl-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]sulfonium; methyl sulfate IUPAC Name: butyl-methyl-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]sulfanium; methyl sulfate Traditional Name: butyl-methyl-[2-[2-(2-phenylphenoxy)ethoxy]ethyl]sulfonium; methyl sulfate Formula: C22H32O6S2 MolecularWeight: 456.61588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[S+](C)CCOCCOC1=CC=CC=C1C2=CC=CC=C2.COS(=O)(=O)[O-]

Isomeric SMILES

CCCC[S+](C)CCOCCOC1=CC=CC=C1C2=CC=CC=C2.COS(=O)(=O)[O-]

InChI

InChI=1S/C21H29O2S.CH4O4S/c1-3-4-17-24(2)18-16-22-14-15-23-21-13-9-8-12-20(21)19-10-6-5-7-11-19;1-5-6(2,3)4/h5-13H,3-4,14-18H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1