2-oxidanyl-5-[2-[4-(phenylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoic acid

Systemtic Name: 2-oxidanyl-5-[2-[4-(phenylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoic acid Openeye Name: 5-[2-[4-(benzenesulfonamido)phenyl]sulfanylpropanoylamino]-2-hydroxy-benzoic acid CAS Name: 5-[[2-[[4-(benzenesulfonamido)phenyl]thio]-1-oxopropyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[2-[4-(benzenesulfonamido)phenyl]sulfanylpropanoylamino]-2-hydroxybenzoic acid Traditional Name: 5-[2-[[4-(benzenesulfonamido)phenyl]thio]propanoylamino]-2-hydroxy-benzoic acid Formula: C22H20N2O6S2 MolecularWeight: 472.534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)O)C(=O)O)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)O)C(=O)O)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O6S2/c1-14(21(26)23-16-9-12-20(25)19(13-16)22(27)28)31-17-10-7-15(8-11-17)24-32(29,30)18-5-3-2-4-6-18/h2-14,24-25H,1H3,(H,23,26)(H,27,28)