2-(1-iodanyltridecyl)octadecanoic acid

Systemtic Name: 2-(1-iodanyltridecyl)octadecanoic acid Openeye Name: 2-(1-iodotridecyl)octadecanoic acid CAS Name: 2-(1-iodotridecyl)octadecanoic acid IUPAC Name: 2-(1-iodotridecyl)octadecanoic acid Traditional Name: 2-(1-iodotridecyl)stearic acid Formula: C31H61IO2 MolecularWeight: 592.71931

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCC)I)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCC)I)C(=O)O

InChI

InChI=1S/C31H61IO2/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29(31(33)34)30(32)28-26-24-22-20-14-12-10-8-6-4-2/h29-30H,3-28H2,1-2H3,(H,33,34)