[4-chloranyl-2-[2-(2-iodanylphenyl)-2-oxidanylidene-ethyl]phenyl] benzenesulfonate

Systemtic Name: [4-chloranyl-2-[2-(2-iodanylphenyl)-2-oxidanylidene-ethyl]phenyl] benzenesulfonate Openeye Name: [4-chloro-2-[2-(2-iodophenyl)-2-oxo-ethyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-chloro-2-[2-(2-iodophenyl)-2-oxoethyl]phenyl] ester IUPAC Name: [4-chloro-2-[2-(2-iodophenyl)-2-oxoethyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-chloro-2-[2-(2-iodophenyl)-2-keto-ethyl]phenyl] ester Formula: C20H14ClIO4S MolecularWeight: 512.74523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)CC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)CC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C20H14ClIO4S/c21-15-10-11-20(26-27(24,25)16-6-2-1-3-7-16)14(12-15)13-19(23)17-8-4-5-9-18(17)22/h1-12H,13H2