sodium 2-[(5-bromanyl-4-fluoranyl-2-nitro-phenyl)amino]ethanoate

Systemtic Name: sodium 2-[(5-bromanyl-4-fluoranyl-2-nitro-phenyl)amino]ethanoate Openeye Name: sodium 2-(5-bromo-4-fluoro-2-nitro-anilino)acetate CAS Name: sodium 2-(5-bromo-4-fluoro-2-nitroanilino)acetate IUPAC Name: sodium 2-(5-bromo-4-fluoro-2-nitroanilino)acetate Traditional Name: sodium 2-(5-bromo-4-fluoro-2-nitro-anilino)acetate Formula: C8H5BrFN2NaO4 MolecularWeight: 315.028473

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Br)F)[N+](=O)[O-])NCC(=O)[O-].[Na+]

Isomeric SMILES

C1=C(C(=CC(=C1Br)F)[N+](=O)[O-])NCC(=O)[O-].[Na+]

InChI

InChI=1S/C8H6BrFN2O4.Na/c9-4-1-6(11-3-8(13)14)7(12(15)16)2-5(4)10;/h1-2,11H,3H2,(H,13,14);/q;+1/p-1