3-(furan-2-ylmethylsulfanyl)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 3-(furan-2-ylmethylsulfanyl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(2-furylmethylsulfanyl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(2-furanylmethylthio)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(furan-2-ylmethylsulfanyl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(2-furfurylthio)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C18H15NO6S2 MolecularWeight: 405.4448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)SCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)SCC3=CC=CO3

InChI

InChI=1S/C18H15NO6S2/c19-27(22,23)16-10-12(18(20)21)9-15(26-11-14-7-4-8-24-14)17(16)25-13-5-2-1-3-6-13/h1-10H,11H2,(H,20,21)(H2,19,22,23)