5-(ethylcarbamoyl)-2-[4-(ethylcarbamoyl)-2-oxidanidylperoxysulfanyl-phenyl]benzenesulfonate

Systemtic Name: 5-(ethylcarbamoyl)-2-[4-(ethylcarbamoyl)-2-oxidanidylperoxysulfanyl-phenyl]benzenesulfonate Openeye Name: 5-(ethylcarbamoyl)-2-[4-(ethylcarbamoyl)-2-oxidoperoxysulfanyl-phenyl]benzenesulfonate CAS Name: 5-(ethylcarbamoyl)-2-[4-(ethylcarbamoyl)-2-(oxidodioxythio)phenyl]benzenesulfonate IUPAC Name: 5-(ethylcarbamoyl)-2-[4-(ethylcarbamoyl)-2-oxidoperoxysulfanylphenyl]benzenesulfonate Traditional Name: 5-(ethylcarbamoyl)-2-[4-(ethylcarbamoyl)-2-(oxidoperoxythio)phenyl]besylate Formula: C18H18N2O8S2-2 MolecularWeight: 454.47412

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NCC)S(=O)(=O)[O-])SOO[O-]

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NCC)S(=O)(=O)[O-])SOO[O-]

InChI

InChI=1S/C18H20N2O8S2/c1-3-19-17(21)11-5-7-13(15(9-11)29-28-27-23)14-8-6-12(18(22)20-4-2)10-16(14)30(24,25)26/h5-10,23H,3-4H2,1-2H3,(H,19,21)(H,20,22)(H,24,25,26)/p-2