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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NCCSC2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NCCSC2=CC=C(C=C2)OCC(=O)O

InChI

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