(E)-5-[3-(phenylsulfonylamino)phenyl]pent-2-enoic acid

Systemtic Name: (E)-5-[3-(phenylsulfonylamino)phenyl]pent-2-enoic acid Openeye Name: (E)-5-[3-(benzenesulfonamido)phenyl]pent-2-enoic acid CAS Name: (E)-5-[3-(benzenesulfonamido)phenyl]-2-pentenoic acid IUPAC Name: (E)-5-[3-(benzenesulfonamido)phenyl]pent-2-enoic acid Traditional Name: (E)-5-[3-(benzenesulfonamido)phenyl]pent-2-enoic acid Formula: C17H17NO4S MolecularWeight: 331.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CCC=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CC/C=C/C(=O)O

InChI

InChI=1S/C17H17NO4S/c19-17(20)12-5-4-7-14-8-6-9-15(13-14)18-23(21,22)16-10-2-1-3-11-16/h1-3,5-6,8-13,18H,4,7H2,(H,19,20)/b12-5+