2-(2-iodosyl-3,5-dioctadecyl-phenyl)ethanoic acid

Systemtic Name: 2-(2-iodosyl-3,5-dioctadecyl-phenyl)ethanoic acid Openeye Name: 2-(2-iodosyl-3,5-dioctadecyl-phenyl)acetic acid CAS Name: 2-(2-iodosyl-3,5-dioctadecylphenyl)acetic acid IUPAC Name: 2-(2-iodosyl-3,5-dioctadecylphenyl)acetic acid Traditional Name: 2-(2-iodosyl-3,5-distearyl-phenyl)acetic acid Formula: C44H79IO3 MolecularWeight: 783.00073

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C44H79IO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40-37-41(44(45-48)42(38-40)39-43(46)47)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37-38H,3-36,39H2,1-2H3,(H,46,47)