[4-(4-iodophenyl)phenyl] 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [4-(4-iodophenyl)phenyl] 4-(methylsulfonylmethyl)benzoate Openeye Name: [4-(4-iodophenyl)phenyl] 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [4-(4-iodophenyl)phenyl] ester IUPAC Name: [4-(4-iodophenyl)phenyl] 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [4-(4-iodophenyl)phenyl] ester Formula: C21H17IO4S MolecularWeight: 492.32675

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)I

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)I

InChI

InChI=1S/C21H17IO4S/c1-27(24,25)14-15-2-4-18(5-3-15)21(23)26-20-12-8-17(9-13-20)16-6-10-19(22)11-7-16/h2-13H,14H2,1H3