sodium (4-fluoranyl-2-nitro-phenyl)methanesulfonic acid

Systemtic Name: sodium (4-fluoranyl-2-nitro-phenyl)methanesulfonic acid Openeye Name: sodium (4-fluoro-2-nitro-phenyl)methanesulfonic acid CAS Name: sodium (4-fluoro-2-nitrophenyl)methanesulfonic acid IUPAC Name: sodium (4-fluoro-2-nitrophenyl)methanesulfonic acid Traditional Name: sodium (4-fluoro-2-nitro-phenyl)methanesulfonic acid Formula: C7H6FNNaO5S+ MolecularWeight: 258.179413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)[N+](=O)[O-])CS(=O)(=O)O.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1F)[N+](=O)[O-])CS(=O)(=O)O.[Na+]

InChI

InChI=1S/C7H6FNO5S.Na/c8-6-2-1-5(4-15(12,13)14)7(3-6)9(10)11;/h1-3H,4H2,(H,12,13,14);/q;+1