3-(3-methylsulfonylphenyl)carbonyloxypropyl 3-methylsulfonylbenzoate

Systemtic Name: 3-(3-methylsulfonylphenyl)carbonyloxypropyl 3-methylsulfonylbenzoate Openeye Name: 3-(3-methylsulfonylbenzoyl)oxypropyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid 3-[(3-methylsulfonylphenyl)-oxomethoxy]propyl ester IUPAC Name: 3-(3-methylsulfonylbenzoyl)oxypropyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid 3-(3-mesylbenzoyl)oxypropyl ester Formula: C19H20O8S2 MolecularWeight: 440.4873

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCCCOC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCCCOC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H20O8S2/c1-28(22,23)16-8-3-6-14(12-16)18(20)26-10-5-11-27-19(21)15-7-4-9-17(13-15)29(2,24)25/h3-4,6-9,12-13H,5,10-11H2,1-2H3