2-[2-(methylsulfamoyl)-4-nitro-phenyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-(methylsulfamoyl)-4-nitro-phenyl]sulfanylbenzoic acid Openeye Name: 2-[2-(methylsulfamoyl)-4-nitro-phenyl]sulfanylbenzoic acid CAS Name: 2-[[2-(methylsulfamoyl)-4-nitrophenyl]thio]benzoic acid IUPAC Name: 2-[2-(methylsulfamoyl)-4-nitrophenyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(methylsulfamoyl)-4-nitro-phenyl]thio]benzoic acid Formula: C14H12N2O6S2 MolecularWeight: 368.38488

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H12N2O6S2/c1-15-24(21,22)13-8-9(16(19)20)6-7-12(13)23-11-5-3-2-4-10(11)14(17)18/h2-8,15H,1H3,(H,17,18)