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

Systemtic Name: 2-[4-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]phenyl]acetic acid CAS Name: 2-[4-[2-[(4-nitrophenyl)sulfonylamino]ethylthio]phenyl]acetic acid IUPAC Name: 2-[4-[2-[(4-nitrophenyl)sulfonylamino]ethylsulfanyl]phenyl]acetic acid Traditional Name: 2-[4-[2-(nosylamino)ethylthio]phenyl]acetic acid Formula: C16H16N2O6S2 MolecularWeight: 396.43804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)SCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O6S2/c19-16(20)11-12-1-5-14(6-2-12)25-10-9-17-26(23,24)15-7-3-13(4-8-15)18(21)22/h1-8,17H,9-11H2,(H,19,20)