2-(3-nitrophenyl)sulfonylsulfanylethanoic acid

Systemtic Name: 2-(3-nitrophenyl)sulfonylsulfanylethanoic acid Openeye Name: 2-(3-nitrophenyl)sulfonylsulfanylacetic acid CAS Name: 2-[(3-nitrophenyl)sulfonylthio]acetic acid IUPAC Name: 2-(3-nitrophenyl)sulfonylsulfanylacetic acid Traditional Name: 2-[(3-nitrophenyl)sulfonylthio]acetic acid Formula: C8H7NO6S2 MolecularWeight: 277.27428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)SCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)SCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H7NO6S2/c10-8(11)5-16-17(14,15)7-3-1-2-6(4-7)9(12)13/h1-4H,5H2,(H,10,11)