2-[3-chloranyl-4-[(Z)-3-(4-iodophenyl)-3-phenyl-prop-2-enyl]sulfanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-[(Z)-3-(4-iodophenyl)-3-phenyl-prop-2-enyl]sulfanyl-phenoxy]ethanoic acid Openeye Name: 2-[3-chloro-4-[(Z)-3-(4-iodophenyl)-3-phenyl-allyl]sulfanyl-phenoxy]acetic acid CAS Name: 2-[3-chloro-4-[[(Z)-3-(4-iodophenyl)-3-phenylprop-2-enyl]thio]phenoxy]acetic acid IUPAC Name: 2-[3-chloro-4-[(Z)-3-(4-iodophenyl)-3-phenylprop-2-enyl]sulfanylphenoxy]acetic acid Traditional Name: 2-[3-chloro-4-[[(Z)-3-(4-iodophenyl)-3-phenyl-allyl]thio]phenoxy]acetic acid Formula: C23H18ClIO3S MolecularWeight: 536.80969

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)/C(=C/CSC2=C(C=C(C=C2)OCC(=O)O)Cl)/C3=CC=C(C=C3)I

InChI

InChI=1S/C23H18ClIO3S/c24-21-14-19(28-15-23(26)27)10-11-22(21)29-13-12-20(16-4-2-1-3-5-16)17-6-8-18(25)9-7-17/h1-12,14H,13,15H2,(H,26,27)/b20-12-