(2-iodyl-3,5-dioctadecyl-phenyl) dihydrogen phosphate

Systemtic Name: (2-iodyl-3,5-dioctadecyl-phenyl) dihydrogen phosphate Openeye Name: (2-iodyl-3,5-dioctadecyl-phenyl) dihydrogen phosphate CAS Name: (2-iodyl-3,5-dioctadecylphenyl) dihydrogen phosphate IUPAC Name: (2-iodyl-3,5-dioctadecylphenyl) dihydrogen phosphate Traditional Name: (2-iodyl-3,5-distearyl-phenyl) dihydrogen phosphate Formula: C42H78IO6P MolecularWeight: 836.943351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)OP(=O)(O)O)I(=O)=O)CCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)OP(=O)(O)O)I(=O)=O)CCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C42H78IO6P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-37-40(42(43(44)45)41(38-39)49-50(46,47)48)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37-38H,3-36H2,1-2H3,(H2,46,47,48)