2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)-4-phenoxy-benzenesulfonic acid

Systemtic Name: 2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)-4-phenoxy-benzenesulfonic acid Openeye Name: 2-(2-furylmethylamino)-5-(methylsulfamoyl)-4-phenoxy-benzenesulfonic acid CAS Name: 2-(2-furanylmethylamino)-5-(methylsulfamoyl)-4-phenoxybenzenesulfonic acid IUPAC Name: 2-(furan-2-ylmethylamino)-5-(methylsulfamoyl)-4-phenoxybenzenesulfonic acid Traditional Name: 2-(2-furfurylamino)-5-(methylsulfamoyl)-4-phenoxy-besylic acid Formula: C18H18N2O7S2 MolecularWeight: 438.47472

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=C(C(=C1)S(=O)(=O)O)NCC2=CC=CO2)OC3=CC=CC=C3

Isomeric SMILES

CNS(=O)(=O)C1=C(C=C(C(=C1)S(=O)(=O)O)NCC2=CC=CO2)OC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O7S2/c1-19-28(21,22)18-11-17(29(23,24)25)15(20-12-14-8-5-9-26-14)10-16(18)27-13-6-3-2-4-7-13/h2-11,19-20H,12H2,1H3,(H,23,24,25)