4-hexadecoxy-3,5-bis(iodanyl)benzoic acid

Systemtic Name: 4-hexadecoxy-3,5-bis(iodanyl)benzoic acid Openeye Name: 4-hexadecoxy-3,5-diiodo-benzoic acid CAS Name: 4-hexadecoxy-3,5-diiodobenzoic acid IUPAC Name: 4-hexadecoxy-3,5-diiodobenzoic acid Traditional Name: 4-cetyloxy-3,5-diiodo-benzoic acid Formula: C23H36I2O3 MolecularWeight: 614.33908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1I)C(=O)O)I

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1I)C(=O)O)I

InChI

InChI=1S/C23H36I2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-28-22-20(24)17-19(23(26)27)18-21(22)25/h17-18H,2-16H2,1H3,(H,26,27)