2-[4-[3,3-bis(2-iodanylphenyl)prop-2-enylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3,3-bis(2-iodanylphenyl)prop-2-enylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3,3-bis(2-iodophenyl)allylsulfanyl]phenoxy]acetic acid CAS Name: 2-[4-[3,3-bis(2-iodophenyl)prop-2-enylthio]phenoxy]acetic acid IUPAC Name: 2-[4-[3,3-bis(2-iodophenyl)prop-2-enylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[4-[3,3-bis(2-iodophenyl)allylthio]phenoxy]acetic acid Formula: C23H18I2O3S MolecularWeight: 628.26116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=CC=C3I)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=CC=C3I)I

InChI

InChI=1S/C23H18I2O3S/c24-21-7-3-1-5-19(21)18(20-6-2-4-8-22(20)25)13-14-29-17-11-9-16(10-12-17)28-15-23(26)27/h1-13H,14-15H2,(H,26,27)