2-[[4-chloranyl-2-(phenylsulfonylamino)phenoxy]methyl]benzoic acid

Systemtic Name: 2-[[4-chloranyl-2-(phenylsulfonylamino)phenoxy]methyl]benzoic acid Openeye Name: 2-[[2-(benzenesulfonamido)-4-chloro-phenoxy]methyl]benzoic acid CAS Name: 2-[[2-(benzenesulfonamido)-4-chlorophenoxy]methyl]benzoic acid IUPAC Name: 2-[[2-(benzenesulfonamido)-4-chlorophenoxy]methyl]benzoic acid Traditional Name: 2-[[2-(benzenesulfonamido)-4-chloro-phenoxy]methyl]benzoic acid Formula: C20H16ClNO5S MolecularWeight: 417.86274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H16ClNO5S/c21-15-10-11-19(27-13-14-6-4-5-9-17(14)20(23)24)18(12-15)22-28(25,26)16-7-2-1-3-8-16/h1-12,22H,13H2,(H,23,24)