[3-(2-methylsulfonylphenyl)phenyl] 4-[(5-cyano-2-oxidanyl-phenyl)sulfonylamino]butaneperoxoate

Systemtic Name: [3-(2-methylsulfonylphenyl)phenyl] 4-[(5-cyano-2-oxidanyl-phenyl)sulfonylamino]butaneperoxoate Openeye Name: [3-(2-methylsulfonylphenyl)phenyl] 4-[(5-cyano-2-hydroxy-phenyl)sulfonylamino]butaneperoxoate CAS Name: 4-[(5-cyano-2-hydroxyphenyl)sulfonylamino]butaneperoxoic acid [3-(2-methylsulfonylphenyl)phenyl] ester IUPAC Name: [3-(2-methylsulfonylphenyl)phenyl] 4-[(5-cyano-2-hydroxyphenyl)sulfonylamino]butaneperoxoate Traditional Name: 4-[(5-cyano-2-hydroxy-phenyl)sulfonylamino]peroxybutyric acid [3-(2-mesylphenyl)phenyl] ester Formula: C24H22N2O8S2 MolecularWeight: 530.57008

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC(=CC=C2)OOC(=O)CCCNS(=O)(=O)C3=C(C=CC(=C3)C#N)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC(=CC=C2)OOC(=O)CCCNS(=O)(=O)C3=C(C=CC(=C3)C#N)O

InChI

InChI=1S/C24H22N2O8S2/c1-35(29,30)22-9-3-2-8-20(22)18-6-4-7-19(15-18)33-34-24(28)10-5-13-26-36(31,32)23-14-17(16-25)11-12-21(23)27/h2-4,6-9,11-12,14-15,26-27H,5,10,13H2,1H3