2-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]-2-phenoxy-ethanoic acid

Systemtic Name: 2-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]-2-phenoxy-ethanoic acid Openeye Name: 2-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]-2-phenoxy-acetic acid CAS Name: 2-[2-[(4-nitrophenyl)sulfonylamino]ethylthio]-2-phenoxyacetic acid IUPAC Name: 2-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]-2-phenoxyacetic acid Traditional Name: 2-[2-(nosylamino)ethylthio]-2-phenoxy-acetic acid Formula: C16H16N2O7S2 MolecularWeight: 412.43744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(C(=O)O)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC(C(=O)O)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O7S2/c19-15(20)16(25-13-4-2-1-3-5-13)26-11-10-17-27(23,24)14-8-6-12(7-9-14)18(21)22/h1-9,16-17H,10-11H2,(H,19,20)