4-[[3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanyl-naphthalen-1-yl]sulfamoyl]benzoate

Systemtic Name: 4-[[3-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanyl-naphthalen-1-yl]sulfamoyl]benzoate Openeye Name: 4-[[4-hydroxy-3-(2-oxido-2-oxo-ethyl)sulfanyl-1-naphthyl]sulfamoyl]benzoate CAS Name: 4-[[4-hydroxy-3-[(2-oxido-2-oxoethyl)thio]-1-naphthalenyl]sulfamoyl]benzoate IUPAC Name: 4-[[4-hydroxy-3-(2-oxido-2-oxoethyl)sulfanylnaphthalen-1-yl]sulfamoyl]benzoate Traditional Name: 4-[[4-hydroxy-3-[(2-keto-2-oxido-ethyl)thio]-1-naphthyl]sulfamoyl]benzoate Formula: C19H13NO7S2-2 MolecularWeight: 431.43902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)SCC(=O)[O-])NS(=O)(=O)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)SCC(=O)[O-])NS(=O)(=O)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C19H15NO7S2/c21-17(22)10-28-16-9-15(13-3-1-2-4-14(13)18(16)23)20-29(26,27)12-7-5-11(6-8-12)19(24)25/h1-9,20,23H,10H2,(H,21,22)(H,24,25)/p-2