[4-(4-iodophenyl)phenyl] 3-(methylsulfonylmethyl)benzoate

Systemtic Name: [4-(4-iodophenyl)phenyl] 3-(methylsulfonylmethyl)benzoate Openeye Name: [4-(4-iodophenyl)phenyl] 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid [4-(4-iodophenyl)phenyl] ester IUPAC Name: [4-(4-iodophenyl)phenyl] 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(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=CC(=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)I

Isomeric SMILES

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

InChI

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